# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-02-15T03:52:41+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 = 57 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
"1560723","11.204","0.005","17.824","0.005","15.275","0.005","90","0.005","97.916","0.005","90","0.005","3021.4","1.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H46 N3 P Si3 -","- C26 H46 N3 P Si3 -","- C104 H184 N12 P4 Si12 -","4","1","","Takahashi, Shintaro; Ishii, Akihiko; Nakata, Norio","Interconversion between a silaimine and an aminosilylene supported by an iminophosphonamide ligand.","Chemical communications (Cambridge, England)","2021","57","26","3203","3206","10.1039/d1cc00667c","","","0.71069","MoKα","","0.0418","0.0362","","","0.1028","0.1062","","","","","","1.013","","","","has coordinates","301787","2025-08-18","22:19:33",""
"1560724","10.9693","0.0008","19.9448","0.0015","15.9939","0.0012","90","","91.8748","0.001","90","","3497.3","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H52 N3 P Se Si3 -","- C32 H52 N3 P Se Si3 -","- C128 H208 N12 P4 Se4 Si12 -","4","1","","Takahashi, Shintaro; Ishii, Akihiko; Nakata, Norio","Interconversion between a silaimine and an aminosilylene supported by an iminophosphonamide ligand.","Chemical communications (Cambridge, England)","2021","57","26","3203","3206","10.1039/d1cc00667c","","","0.71073","MoKα","","0.0377","0.0334","","","0.0841","0.0861","","","","","","1.029","","","","has coordinates,has disorder","301787","2025-08-18","22:19:33",""
"1560725","15.6803","0.0019","10.0386","0.0012","42.425","0.005","90","","92.403","0.002","90","","6672.2","1.4","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H28 Cl N2 P Se Si -","- C20 H28 Cl N2 P Se Si -","- C240 H336 Cl12 N24 P12 Se12 Si12 -","12","1.5","","Takahashi, Shintaro; Ishii, Akihiko; Nakata, Norio","Interconversion between a silaimine and an aminosilylene supported by an iminophosphonamide ligand.","Chemical communications (Cambridge, England)","2021","57","26","3203","3206","10.1039/d1cc00667c","","","0.71073","MoKα","","0.0757","0.0525","","","0.133","0.1404","","","","","","1.01","","","","has coordinates,has disorder","263634","2021-04-05","13:58:21",""
"1561776","9.4427","0.0002","38.5575","0.0006","9.5037","0.0002","90","","94.951","0.002","90","","3447.26","0.12","172.99","0.1","172.99","0.1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C35 H32 B Cl2 Cu N4 P2 S -","- C35 H32 B Cl2 Cu N4 P2 S -","- C140 H128 B4 Cl8 Cu4 N16 P8 S4 -","4","1","","Yu, Xiao; Li, Xiaoyue; Cai, Zelun; Sun, Lingzhi; Wang, Chengbo; Rao, Haixia; Wei, Chen; Bian, Zuqiang; Jin, Qionghua; Liu, Zhiwei","Mechanochromic properties in a mononuclear Cu(I) complex without cuprophilic interactions.","Chemical communications (Cambridge, England)","2021","57","41","5082","5085","10.1039/d1cc01229k","","x-ray","1.54184","CuKα","","0.0765","0.0727","","","0.2125","0.2166","","","","","","1.064","","","","has coordinates","265856","2021-06-05","17:22:07",""
"1561777","11.20173","0.00011","8.45092","0.00009","18.9038","0.0002","90","","96.6573","0.001","90","","1777.46","0.03","173","","173","","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C35 H32 B Cl2 Cu N4 P2 S -","- C35 H32 B Cl2 Cu N4 P2 S -","- C70 H64 B2 Cl4 Cu2 N8 P4 S2 -","2","1","","Yu, Xiao; Li, Xiaoyue; Cai, Zelun; Sun, Lingzhi; Wang, Chengbo; Rao, Haixia; Wei, Chen; Bian, Zuqiang; Jin, Qionghua; Liu, Zhiwei","Mechanochromic properties in a mononuclear Cu(I) complex without cuprophilic interactions.","Chemical communications (Cambridge, England)","2021","57","41","5082","5085","10.1039/d1cc01229k","","x-ray","1.54184","CuKα","","0.0517","0.0509","","","0.1366","0.1377","","","","","","1.035","","","","has coordinates","265856","2021-06-05","17:22:07",""
"1562686","12.102","0.002","23.347","0.006","31.702","0.009","90","","99.798","0.016","90","","8827","4","173","2","172.99","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C90 H54 Br6 I2 N12 O12 -","- C90 H54 Br6 I2 N12 O12 -","- C360 H216 Br24 I8 N48 O48 -","4","1","","Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao","A water-soluble naphthalenediimide-containing hexacationic cage.","Chemical communications (Cambridge, England)","2021","57","49","6074","6077","10.1039/d1cc02242c","","","1.34139","GaKα","","0.2163","0.1368","","","0.3099","0.3416","","","","","","1.37","","","","has coordinates,has disorder","267039","2021-07-05","16:22:29",""
"1562687","14.159","0.007","23.995","0.013","14.229","0.007","90","","104.068","0.014","90","","4689","4","170","2","169.96","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C90 H60 Br6 N12 O15 -","- C90 H60 Br6 N12 O15 -","- C180 H120 Br12 N24 O30 -","2","1","","Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao","A water-soluble naphthalenediimide-containing hexacationic cage.","Chemical communications (Cambridge, England)","2021","57","49","6074","6077","10.1039/d1cc02242c","","","1.34139","GaKα","","0.1844","0.087","","","0.2093","0.2689","","","","","","0.961","","","","has coordinates","267039","2021-07-05","16:22:29",""
"1562688","12.1313","0.0008","23.4871","0.0017","31.769","0.002","90","","99.44","0.004","90","","8929.3","1","173","2","172.99","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C90 H54 Br2 I6 N12 O12 -","- C90 H54 Br2 I6 N12 O12 -","- C360 H216 Br8 I24 N48 O48 -","4","1","","Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao","A water-soluble naphthalenediimide-containing hexacationic cage.","Chemical communications (Cambridge, England)","2021","57","49","6074","6077","10.1039/d1cc02242c","","","1.34139","GaKα","","0.2937","0.1652","","","0.3397","0.3825","","","","","","1.649","","","","has coordinates","267039","2021-07-05","16:22:29",""
"1562689","14.4602","0.0005","21.9065","0.0008","25.836","0.001","106.98","0.001","100.14","0.001","109.181","0.001","7049.7","0.5","170","2","170","","","","","","","","","5","P -1","-P 1","2","","","","- C150 H108 Br6 N12 O27 -","- C150 H108 Br6 N12 O27 -","- C300 H216 Br12 N24 O54 -","2","1","","Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao","A water-soluble naphthalenediimide-containing hexacationic cage.","Chemical communications (Cambridge, England)","2021","57","49","6074","6077","10.1039/d1cc02242c","","","0.71073","MoKα","","0.1767","0.1393","","","0.3247","0.3485","","","","","","1.043","","","","has coordinates","267039","2021-07-05","16:22:29",""
"1562690","21.62","0.003","25.189","0.003","26.682","0.003","99.495","0.009","108.239","0.007","105.86","0.007","12767","3","173","2","173","","","","","","","","","5","P -1","-P 1","2","","","","- C233 H147 Br12 N24 O49 -","- C233 H147 Br12 N24 O49 -","- C466 H294 Br24 N48 O98 -","2","1","","Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao","A water-soluble naphthalenediimide-containing hexacationic cage.","Chemical communications (Cambridge, England)","2021","57","49","6074","6077","10.1039/d1cc02242c","","","1.34139","GaKα","","0.1836","0.1431","","","0.3051","0.3198","","","","","","1.007","","","","has coordinates,has disorder","267039","2021-07-05","16:22:29",""
"1562691","18.8016","0.0017","21.9859","0.0017","28.453","0.002","90","","108.666","0.006","90","","11143","1.6","170","2","170","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C100 H65 Br6 N12 O15 -","- C100 H65 Br6 N12 O15 -","- C400 H260 Br24 N48 O60 -","4","1","","Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao","A water-soluble naphthalenediimide-containing hexacationic cage.","Chemical communications (Cambridge, England)","2021","57","49","6074","6077","10.1039/d1cc02242c","","","1.34139","GaKα","","0.2889","0.1777","","","0.3724","0.4512","","","","","","1.044","","","","has coordinates","267039","2021-07-05","16:22:29",""
"1565103","27.0219","0.0003","9.8218","0.0001","18.6325","0.0002","90","","90","","90","","4945.13","0.09","150","","150","","","","","","","","","8","P c a 21","P 2c -2ac","29","","","","- C16 H17 Cl2 F6 I N2 O6 S2 -","- C16 H17 Cl2 F6 I N2 O6 S2 -","- C128 H136 Cl16 F48 I8 N16 O48 S16 -","8","2","","Bakro, Aseel; Sharp-Bucknall, Lachlan; Poynder, Tiffany B.; Clegg, Jack K.; Wilson, David J. D.; Dutton, Jason L.","Lewis acid activation of Weiss’ reagents ([PhI(Pyr) <sub>2</sub> ] <sup>2+</sup> ) with boranes and isolation of [PhI(4-DMAP)] <sup>2+</sup>","Chemical Communications","2021","57","91","12163","12166","10.1039/D1CC04725F","","","1.54184","CuKα","","0.0549","0.0538","","","0.1403","0.1417","","","","","","1.0344","","","","has coordinates","282777","2023-04-20","11:56:53",""
"1565263","12.54","0.003","7.6545","0.0016","5.8345","0.0012","90","","90","","90","","560","0.2","300","2","300","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Li Mn P S4 -","- Li Mn P S4 -","- Li4 Mn4 P4 S16 -","4","0.5","","Balijapelly, Srikanth; Ghosh, Kartik; Chernatynskiy, Aleksandr V.; Choudhury, Amitava","Discovery of an olivine-type lithium manganese thiophosphate, LiMnPS <sub>4</sub> , <i>via</i> a building block approach","Chemical Communications","2021","57","97","13182","13185","10.1039/D1CC05168G","","","0.71073","MoKα","","0.0395","0.033","","","0.0806","0.0852","","","","","","1.112","","","","has coordinates","282777","2023-04-20","11:56:53",""
"7127432","18.134","0.002","10.7534","0.0012","20.059","0.002","90","","117.509","0.007","90","","3469.3","0.7","300","2","300","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H18 F4 O4 S8 -","- C32 H18 F4 O4 S8 -","- C128 H72 F16 O16 S32 -","4","1","","Zhou, Hua-Qun; He, Yonghe; Hu, Jie-Ying; Chung, Lai-Hon; Gu, Qinfen; Liao, Wei-Ming; Zeller, Matthias; Xu, Zhengtao; He, Jun","Conjugated crosslinks boost the conductivity and stability of a single crystalline metal-organic framework.","Chemical communications (Cambridge, England)","2021","57","2","187","190","10.1039/d0cc06765b","","","1.54178","CuKα","","0.0767","0.0528","","","0.1328","0.1616","","","","","","1.046","","","","has coordinates,has disorder","301860","2025-08-22","09:26:42",""
"7127433","9.6365","0.0003","11.875","0.0005","21.5769","0.0006","99.134","0.003","92.375","0.002","111.125","0.003","2260.9","0.14","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C92 H118 Cl4 O15 P4 -","- C92 H118 Cl4 O15 P4 -","- C92 H118 Cl4 O15 P4 -","1","0.5","","Hu, Shanshan; Sun, Wenyu; Chen, Junhong; Li, Sipei; Zhao, Runmin; Xu, Pengxiang; Gao, Yuxing; Zhao, Yufen","Palladium-catalyzed C-P cross-coupling of allenic alcohols with <i>H</i>-phosphonates leading to 2-phosphinoyl-1,3-butadienes.","Chemical communications (Cambridge, England)","2021","57","3","339","342","10.1039/d0cc07022j","","x-ray","1.54184","CuKα","","0.0536","0.0472","","","0.125","0.1344","","","","","","1.025","","","","has coordinates,has disorder","261568","2021-02-04","22:46:15",""
"7127435","10.095","0.002","30.238","0.006","33.51","0.007","90","","90","","90","","10229","4","100","","100","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0417","0.0415","","","0.1216","0.1218","","","","","","1.036","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127436","10.198","0.002","30.356","0.006","33.691","0.007","90","","90","","90","","10430","4","180","","180","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0619","0.0579","","","0.1681","0.1747","","","","","","1.059","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127437","10.1","0.002","30.244","0.006","33.527","0.007","90","","90","","90","","10241","4","110","","110","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0447","0.0444","","","0.1297","0.13","","","","","","1.052","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127438","10.113","0.002","30.265","0.006","33.554","0.007","90","","90","","90","","10270","4","140","","140","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0513","0.0505","","","0.1466","0.1478","","","","","","1.034","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127439","10.121","0.002","30.275","0.006","33.568","0.007","90","","90","","90","","10286","4","150","","150","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0544","0.0531","","","0.155","0.1569","","","","","","1.055","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127440","10.261","0.002","30.428","0.006","33.801","0.007","90","","90","","90","","10553","4","200","","200","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0781","0.0666","","","0.1957","0.2116","","","","","","1.003","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127441","10.286","0.002","30.443","0.006","33.846","0.007","90","","90","","90","","10598","4","210","","210","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0978","0.0761","","","0.2232","0.2512","","","","","","0.956","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127442","10.318","0.002","30.455","0.006","33.903","0.007","90","","90","","90","","10653","4","220","","220","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.1296","0.0876","","","0.2482","0.3025","","","","","","0.963","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127443","10.362","0.002","30.494","0.006","33.987","0.007","90","","90","","90","","10739","4","230","","230","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.1501","0.1","","","0.2654","0.3181","","","","","","0.965","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127444","10.104","0.002","30.25","0.006","33.535","0.007","90","","90","","90","","10250","4","120","","120","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0472","0.0467","","","0.1362","0.137","","","","","","1.044","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127445","10.137","0.002","30.295","0.006","33.599","0.007","90","","90","","90","","10318","4","160","","160","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0602","0.0578","","","0.1642","0.1678","","","","","","1.047","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127446","10.164","0.002","30.319","0.006","33.642","0.007","90","","90","","90","","10367","4","170","","170","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0624","0.0588","","","0.1684","0.1734","","","","","","1.047","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127447","10.107","0.002","30.257","0.006","33.542","0.007","90","","90","","90","","10257","4","130","","130","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.0494","0.0488","","","0.1419","0.1429","","","","","","1.042","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127448","10.472","0.002","30.641","0.006","34.155","0.007","90","","90","","90","","10959","4","250","","250","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.1207","0.0924","","","0.2592","0.2961","","","","","","1.04","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127449","10.233","0.002","30.396","0.006","33.745","0.007","90","","90","","90","","10496","4","190","","190","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","MoKα","","0.0616","0.0569","","","0.1699","0.1771","","","","","","1.036","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127450","10.424","0.002","30.568","0.006","34.109","0.007","90","","90","","90","","10869","4","240","","240","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C31 H25 Au2 Fe N11 O6 -","- C31 H25 Au2 Fe N11 O6 -","- C248 H200 Au16 Fe8 N88 O48 -","8","1","","Ahmed, Manan; Xie, Zixi; Thoonen, Shannon; Hua, Carol; Kepert, Cameron J.; Price, Jason R.; Neville, Suzanne M.","A new spin crossover Fe<sup>II</sup> coordination environment in a two-fold interpenetrated 3-D Hofmann-type framework material.","Chemical communications (Cambridge, England)","2021","57","1","85","88","10.1039/d0cc07326a","","","0.71073","Synchrotron","","0.1574","0.1065","","","0.2868","0.3397","","","","","","1.032","","","","has coordinates","261520","2021-02-04","22:25:22",""
"7127453","8.182","0.003","16.379","0.007","9.224","0.004","90","","93.177","0.005","90","","1234.2","0.9","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H29 Co N7 O14 -","- C15 H29 Co N7 O14 -","- C30 H58 Co2 N14 O28 -","2","1","","Choudhury, Anup; Pichon, Céline; Sutter, Jean-Pascal; Pamu, Dobbidi; Sarma, Bipul; Mudoi, Prashurya Pritam; Gogoi, Nayanmoni","Accessing water processable cyanido bridged chiral heterobimetallic Co(ii)-Fe(iii) one dimensional network.","Chemical communications (Cambridge, England)","2021","57","2","207","210","10.1039/d0cc05356b","","","0.71073","MoKα","","0.068","0.0458","","","0.0911","0.1005","","","","","","1.02","","","","has coordinates","301860","2025-08-22","09:26:42",""
"7127454","10.251","0.005","11.759","0.005","11.983","0.005","92.379","0.005","91.977","0.005","91.531","0.005","1441.8","1.1","100","2","100","2","","","","","","","","7","P 1","P 1","1","","","","- C42 H48 Co2 Fe2 K2 N22 O11 -","- C42 H44 Co2 Fe2 K2 N22 O11 -","- C42 H44 Co2 Fe2 K2 N22 O11 -","1","1","","Choudhury, Anup; Pichon, Céline; Sutter, Jean-Pascal; Pamu, Dobbidi; Sarma, Bipul; Mudoi, Prashurya Pritam; Gogoi, Nayanmoni","Accessing water processable cyanido bridged chiral heterobimetallic Co(ii)-Fe(iii) one dimensional network.","Chemical communications (Cambridge, England)","2021","57","2","207","210","10.1039/d0cc05356b","","","0.71073","MoKα","","0.1551","0.0908","","","0.1838","0.2102","","","","","","1.287","","","","has coordinates","261542","2021-02-04","22:35:42",""
"7127457","11.0309","0.0012","12.0062","0.0013","12.2428","0.0014","109.57","0.001","111.873","0.001","97.513","0.001","1355.9","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H90 O8 Yb8 -","- C38 H90 O8 Yb8 -","- C38 H90 O8 Yb8 -","1","0.5","","Katzenmayer, Markus M.; Wolf, Benjamin M.; Mortis, Alexandros; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Polymeric dimethylytterbium and the terminal methyl complex (Tp<sup>tBu,Me</sup>)Yb(CH<sub>3</sub>)(thf).","Chemical communications (Cambridge, England)","2021","57","2","243","246","10.1039/d0cc06981g","","","0.71073","MoKα","","0.0599","0.0383","","","0.0812","0.091","","","","","","1.022","","","","has coordinates","261544","2021-02-04","22:36:09",""
"7127458","8.521","0.003","15.07","0.004","18.244","0.005","90","","90","","90","","2342.7","1.2","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H40 O Yb -","- C24 H40 O Yb -","- C96 H160 O4 Yb4 -","4","1","","Katzenmayer, Markus M.; Wolf, Benjamin M.; Mortis, Alexandros; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Polymeric dimethylytterbium and the terminal methyl complex (Tp<sup>tBu,Me</sup>)Yb(CH<sub>3</sub>)(thf).","Chemical communications (Cambridge, England)","2021","57","2","243","246","10.1039/d0cc06981g","","","0.71073","MoKα","","0.0437","0.0294","","","0.0553","0.0605","","","","","","1.034","","","","has coordinates","261544","2021-02-04","22:36:09",""
"7127459","8.8586","0.0004","12.4947","0.0006","21.8119","0.0009","73.769","0.001","86.719","0.001","71.323","0.001","2194.58","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H72 N4 Si8 Yb2 -","- C24 H72 N4 Si8 Yb2 -","- C48 H144 N8 Si16 Yb4 -","2","1","","Katzenmayer, Markus M.; Wolf, Benjamin M.; Mortis, Alexandros; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Polymeric dimethylytterbium and the terminal methyl complex (Tp<sup>tBu,Me</sup>)Yb(CH<sub>3</sub>)(thf).","Chemical communications (Cambridge, England)","2021","57","2","243","246","10.1039/d0cc06981g","","","0.71073","MoKα","","0.0294","0.0225","","","0.0472","0.0501","","","","","","1.028","","","","has coordinates","261544","2021-02-04","22:36:09",""
"7127460","11.6943","0.0012","15.8997","0.0016","19.6227","0.0019","79.97","0.003","80.792","0.003","81.066","0.003","3515.9","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H55 B N6 O1.5 Yb -","- C31 H55 B N6 O1.5 Yb -","- C124 H220 B4 N24 O6 Yb4 -","4","2","","Katzenmayer, Markus M.; Wolf, Benjamin M.; Mortis, Alexandros; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Polymeric dimethylytterbium and the terminal methyl complex (Tp<sup>tBu,Me</sup>)Yb(CH<sub>3</sub>)(thf).","Chemical communications (Cambridge, England)","2021","57","2","243","246","10.1039/d0cc06981g","","","0.71073","MoKα","","0.0664","0.0356","","","0.0719","0.0837","","","","","","1.038","","","","has coordinates,has disorder","261544","2021-02-04","22:36:09",""
"7127471","9.1584","0.0013","10.6273","0.0015","11.0747","0.0016","95.856","0.002","112.392","0.002","103.122","0.002","949.1","0.2","210","2","210","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H17 F O2 -","- C27 H17 F O2 -","- C54 H34 F2 O4 -","2","1","","Tang, Bo-Cheng; He, Cai; Chen, Xiang-Long; Ma, Jin-Tian; Wang, Miao; Wu, Yan-Dong; Wu, An-Xin","Palladium catalyzed annulation of 2-iodobiphenyl with a non-terminal alkene enabled by neighboring group assistance.","Chemical communications (Cambridge, England)","2021","57","1","121","124","10.1039/d0cc07133a","","","0.71073","MoKα","","0.0463","0.0409","","","0.121","0.1289","","","","","","1.094","","","","has coordinates","301860","2025-08-22","09:26:52",""
"7127474","15.6886","0.001","28.4973","0.0018","23.6204","0.0014","90","","93.442","0.002","90","","10541.2","1.1","153","2","152.98","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C100 H164 Dy2 I6 O4 P4 -","- C93 H156 Dy2 I6 O4 P4 -","- C372 H624 Dy8 I24 O16 P16 -","4","1","","Wu, Haipeng; Li, Min; Xia, Zhengqiang; Montigaud, Vincent; Cador, Olivier; Le Guennic, Boris; Ke, Hongshan; Wang, Wenyuan; Xie, Gang; Chen, Sanping; Gao, Shengli","High temperature quantum tunnelling of magnetization and thousand kelvin anisotropy barrier in a Dy<sub>2</sub> single-molecule magnet.","Chemical communications (Cambridge, England)","2021","57","3","371","374","10.1039/d0cc06993k","","","1.54178","CuKα","","0.0286","0.0269","","","0.0751","0.0763","","","","","","1.048","","","","has coordinates","261571","2021-02-04","22:47:36",""
"7127491","13.0721","0.0003","13.0721","0.0003","63.6995","0.0019","90","","90","","120","","9426.6","0.4","150","2","150","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C119 H110 Cl4 Fe6 N12 O47 Zn4 -","- C119 H90 Cl4 Fe6 N12 O46.998 Zn4 -","- C357 H270 Cl12 Fe18 N36 O140.994 Zn12 -","3","0.166667","","Yang, Chao; Wang, Shenyu; Sai, Fusheng; Liu, Dingqi; Sun, Fuxing; Gu, Yu; Wu, Gang","Pentanuclear clusters resembling the cubane-dangler connectivity in the native oxygen-evolving center of photosystem II.","Chemical communications (Cambridge, England)","2021","57","1","113","116","10.1039/d0cc07050e","","","0.71073","MoKα","","0.053","0.0406","","","0.0957","0.1016","","","","","","1.031","","","","has coordinates,has disorder","261526","2021-02-04","22:27:58",""
"7127492","13.1328","0.0003","13.1328","0.0003","63.2624","0.0019","90","","90","","120","","9449.1","0.4","150","2","150","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C119 H110 Cl4 Fe6 Mn4 N12 O47 -","- C119 H90 Cl4 Fe6 Mn4 N12 O46.9998 -","- C357 H270 Cl12 Fe18 Mn12 N36 O140.999 -","3","0.166667","","Yang, Chao; Wang, Shenyu; Sai, Fusheng; Liu, Dingqi; Sun, Fuxing; Gu, Yu; Wu, Gang","Pentanuclear clusters resembling the cubane-dangler connectivity in the native oxygen-evolving center of photosystem II.","Chemical communications (Cambridge, England)","2021","57","1","113","116","10.1039/d0cc07050e","","","0.71073","MoKα","","0.0689","0.0526","","","0.13","0.1388","","","","","","1.081","","","","has coordinates,has disorder","261526","2021-02-04","22:27:58",""
"7127493","14.1061","0.001","14.4531","0.0009","17.9914","0.0012","79.977","0.002","68.32","0.002","72.495","0.002","3242.5","0.4","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C57 H48 Cl2 Fe3 N6 Ni2 O22 -","- C57 H48 Cl2 Fe3 N6 Ni2 O22 -","- C114 H96 Cl4 Fe6 N12 Ni4 O44 -","2","1","","Yang, Chao; Wang, Shenyu; Sai, Fusheng; Liu, Dingqi; Sun, Fuxing; Gu, Yu; Wu, Gang","Pentanuclear clusters resembling the cubane-dangler connectivity in the native oxygen-evolving center of photosystem II.","Chemical communications (Cambridge, England)","2021","57","1","113","116","10.1039/d0cc07050e","","","0.71073","MoKα","","0.1184","0.0969","","","0.2467","0.2709","","","","","","1.039","","","","has coordinates,has disorder","261526","2021-02-04","22:27:58",""
"7127503","13.719","0.0004","13.4877","0.0003","16.7867","0.0004","90","","105.527","0.002","90","","2992.81","0.13","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H32 N2 O5 -","- C34 H32 N2 O5 -","- C136 H128 N8 O20 -","4","1","","Jin, Shaojing; Wang, Lele; Han, Huabin; Liu, Xiongli; Bu, Zhanwei; Wang, Qilin","Assembly of functionalized π-extended indolizine polycycles through dearomative [3+2] cycloaddition/oxidative decarbonylation.","Chemical communications (Cambridge, England)","2021","57","3","359","362","10.1039/d0cc07116a","","x-ray","1.54184","CuKα","","0.0576","0.0456","","","0.1176","0.1291","","","","","","1.028","","","","has coordinates","301860","2025-08-22","09:26:52",""
"7127512","8.334","0.011","10.56","0.013","12.426","0.014","90.25","0.02","107.99","0.02","107.34","0.03","987","2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C52 H42 S2 -","- C52 H42 S2 -","- C52 H42 S2 -","1","0.5","","Schmidt, Maximilian; Wassy, Daniel; Hermann, Mathias; González, M Teresa; Agräit, Nicolás; Zotti, Linda A.; Esser, Birgit; Leary, Edmund","Single-molecule conductance of dibenzopentalenes: antiaromaticity and quantum interference.","Chemical communications (Cambridge, England)","2021","57","6","745","748","10.1039/d0cc06810a","","x-ray","0.71073","MoKα","","0.1011","0.0589","","","0.1375","0.1585","","","","","","1.034","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127513","5.323","0.004","7.924","0.006","28.58","0.02","89.815","0.013","89.07","0.03","89.71","0.02","1205.3","1.5","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H22 S2 -","- C32 H22 S2 -","- C64 H44 S4 -","2","1","","Schmidt, Maximilian; Wassy, Daniel; Hermann, Mathias; González, M Teresa; Agräit, Nicolás; Zotti, Linda A.; Esser, Birgit; Leary, Edmund","Single-molecule conductance of dibenzopentalenes: antiaromaticity and quantum interference.","Chemical communications (Cambridge, England)","2021","57","6","745","748","10.1039/d0cc06810a","","x-ray","0.71073","MoKα","","0.0993","0.0746","","","0.1886","0.2045","","","","","","1.079","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127514","10.284","0.016","7.894","0.017","24.43","0.04","90","","99.52","0.02","90","","1956","6","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C52 H42 S2 -","- C52 H42 S2 -","- C104 H84 S4 -","2","0.5","","Schmidt, Maximilian; Wassy, Daniel; Hermann, Mathias; González, M Teresa; Agräit, Nicolás; Zotti, Linda A.; Esser, Birgit; Leary, Edmund","Single-molecule conductance of dibenzopentalenes: antiaromaticity and quantum interference.","Chemical communications (Cambridge, England)","2021","57","6","745","748","10.1039/d0cc06810a","","x-ray","0.71073","MoKα","","0.1364","0.0929","","","0.2077","0.2348","","","","","","1.1","","","","has coordinates","261552","2021-02-04","22:39:13",""
"7127518","5.4867","0.0005","12.1391","0.0011","28.047","0.003","90","","90","","90","","1868","0.3","90","","90","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H18 Cl2 O2 -","- C23 H18 Cl2 O2 -","- C92 H72 Cl8 O8 -","4","1","","Burde, Ameya S.; Karyakarte, Shuklendu D.; Sylvester, Eric D.; Chemler, Sherry R.","Copper-catalyzed enantioselective synthesis of bridged bicyclic ketals from 1,1-disubstituted-4-methylene-1,6-hexanediols and related alkenols.","Chemical communications (Cambridge, England)","2021","57","1","105","108","10.1039/d0cc06404a","","x-ray","0.71073","MoKα","","0.0371","0.0304","","","0.0685","0.0704","","","","","","1.046","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127519","14.015","0.002","9.4761","0.0009","17.0238","0.0018","90","","95.826","0.006","90","","2249.2","0.5","90","","90","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C31 H28 O2 -","- C31 H28 O2 -","- C124 H112 O8 -","4","1","","Burde, Ameya S.; Karyakarte, Shuklendu D.; Sylvester, Eric D.; Chemler, Sherry R.","Copper-catalyzed enantioselective synthesis of bridged bicyclic ketals from 1,1-disubstituted-4-methylene-1,6-hexanediols and related alkenols.","Chemical communications (Cambridge, England)","2021","57","1","105","108","10.1039/d0cc06404a","","","0.71073","MoKα","","0.0726","0.0593","","","0.1589","0.1662","","","","","","1.079","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127521","10.06","0.0005","12.656","0.0007","34.5461","0.0019","90","","92.8652","0.0018","90","","4392.9","0.4","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C45 H38 Au B F12 N P -","- C45 H38 Au B F12 N P -","- C180 H152 Au4 B4 F48 N4 P4 -","4","1","","Theulier, Cyril A.; García-Rodeja, Yago; Saffon-Merceron, Nathalie; Miqueu, Karinne; Bouhadir, Ghenwa; Bourissou, Didier","1,1-Phosphaboration of C[triple bond, length as m-dash]C and C[double bond, length as m-dash]C bonds at gold.","Chemical communications (Cambridge, England)","2021","57","3","347","350","10.1039/d0cc06978g","","","0.71073","MoKα","","0.0443","0.0305","","","0.0654","0.0701","","","","","","1.094","","","","has coordinates,has disorder","261570","2021-02-04","22:47:18",""
"7127522","14.4357","0.0008","21.5653","0.0015","25.4588","0.0017","87.595","0.003","77.238","0.003","83.387","0.003","7677.2","0.9","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C78 H92 Au B F12 O3 P2 -","- C78 H92 Au B F12 O3 P2 -","- C312 H368 Au4 B4 F48 O12 P8 -","4","2","","Theulier, Cyril A.; García-Rodeja, Yago; Saffon-Merceron, Nathalie; Miqueu, Karinne; Bouhadir, Ghenwa; Bourissou, Didier","1,1-Phosphaboration of C[triple bond, length as m-dash]C and C[double bond, length as m-dash]C bonds at gold.","Chemical communications (Cambridge, England)","2021","57","3","347","350","10.1039/d0cc06978g","","","0.71073","MoKα","","0.0746","0.0387","","","0.0727","0.0832","","","","","","1.048","","","","has coordinates,has disorder","261570","2021-02-04","22:47:22",""
"7127523","15.7366","0.0008","17.7379","0.0009","29.4924","0.0017","90","","105.007","0.0017","90","","7951.6","0.7","193","2","193","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C39 H36 Au B F12 N P -","- C39 H36 Au B F12 N P -","- C312 H288 Au8 B8 F96 N8 P8 -","8","1","","Theulier, Cyril A.; García-Rodeja, Yago; Saffon-Merceron, Nathalie; Miqueu, Karinne; Bouhadir, Ghenwa; Bourissou, Didier","1,1-Phosphaboration of C[triple bond, length as m-dash]C and C[double bond, length as m-dash]C bonds at gold.","Chemical communications (Cambridge, England)","2021","57","3","347","350","10.1039/d0cc06978g","","","0.71073","MoKα","","0.0698","0.0332","","","0.0531","0.0627","","","","","","1.068","","","","has coordinates,has disorder","261570","2021-02-04","22:47:22",""
"7127524","11.2978","0.0007","13.6927","0.001","14.2787","0.001","108.722","0.002","100.233","0.0019","102.532","0.0019","1967.7","0.2","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H36 Au B F12 N P -","- C39 H36 Au B F12 N P -","- C78 H72 Au2 B2 F24 N2 P2 -","2","1","","Theulier, Cyril A.; García-Rodeja, Yago; Saffon-Merceron, Nathalie; Miqueu, Karinne; Bouhadir, Ghenwa; Bourissou, Didier","1,1-Phosphaboration of C[triple bond, length as m-dash]C and C[double bond, length as m-dash]C bonds at gold.","Chemical communications (Cambridge, England)","2021","57","3","347","350","10.1039/d0cc06978g","","","0.71073","MoKα","","0.0534","0.0349","","","0.0584","0.0635","","","","","","1.029","","","","has coordinates,has disorder","261570","2021-02-04","22:47:22",""
"7127525","24.8443","0.0018","22.0162","0.0017","30.643","0.002","90","","90","","90","","16761","2","193","2","193","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C75 H96 Au B Cl6 F12 O3 P2 -","- C75 H96 Au B Cl6 F12 O3 P2 -","- C600 H768 Au8 B8 Cl48 F96 O24 P16 -","8","1","","Theulier, Cyril A.; García-Rodeja, Yago; Saffon-Merceron, Nathalie; Miqueu, Karinne; Bouhadir, Ghenwa; Bourissou, Didier","1,1-Phosphaboration of C[triple bond, length as m-dash]C and C[double bond, length as m-dash]C bonds at gold.","Chemical communications (Cambridge, England)","2021","57","3","347","350","10.1039/d0cc06978g","","","0.71073","MoKα","","0.0695","0.0362","","","0.0797","0.0959","","","","","","1.063","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127526","18.4404","0.001","22.2609","0.0011","23.8142","0.001","90","","90","","90","","9775.7","0.8","193","2","193","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C46 H39 Au B Cl3 F12 N P -","- C46 H39 Au B Cl3 F12 N P -","- C368 H312 Au8 B8 Cl24 F96 N8 P8 -","8","1","","Theulier, Cyril A.; García-Rodeja, Yago; Saffon-Merceron, Nathalie; Miqueu, Karinne; Bouhadir, Ghenwa; Bourissou, Didier","1,1-Phosphaboration of C[triple bond, length as m-dash]C and C[double bond, length as m-dash]C bonds at gold.","Chemical communications (Cambridge, England)","2021","57","3","347","350","10.1039/d0cc06978g","","","0.71073","MoKα","","0.0419","0.0281","","","0.0676","0.0763","","","","","","1.047","","","","has coordinates,has disorder","261570","2021-02-04","22:47:22",""
"7127527","10.4855","0.0004","11.1137","0.0005","12.492","0.0004","111.886","0.004","101.798","0.003","103.943","0.004","1239.04","0.11","150","0.2","150","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H12 N O5 Pb -","- C12 H12 N O5 Pb -","- C48 H48 N4 O20 Pb4 -","4","2","","Chen, Xi; Zhang, Zhongyue; Chen, Jin; Sapchenko, Sergei; Han, Xue; da-Silva, Ivan; Li, Ming; Vitorica-Yrezabal, Inigo J; Whitehead, George; Tang, Chiu C.; Awaga, Kunio; Yang, Sihai; Schröder, Martin","Enhanced proton conductivity in a flexible metal-organic framework promoted by single-crystal-to-single-crystal transformation.","Chemical communications (Cambridge, England)","2021","57","1","65","68","10.1039/d0cc05270a","","x-ray","0.71073","MoKα","","0.0441","0.0358","","","0.0918","0.0946","","","","","","1.01","","","","has coordinates","261525","2021-02-04","22:27:39",""
"7127528","7.3121","0.0017","9.4816","0.0017","11.803","0.003","81.482","0.017","74.95","0.02","73.334","0.018","754.6","0.3","99.8","0.8","99.8","0.8","","","","","","","","4","P -1","-P 1","2","","","","- C16 H8 O9 Pb2 -","- C16 H8 O9 Pb2 -","- C32 H16 O18 Pb4 -","2","1","","Chen, Xi; Zhang, Zhongyue; Chen, Jin; Sapchenko, Sergei; Han, Xue; da-Silva, Ivan; Li, Ming; Vitorica-Yrezabal, Inigo J; Whitehead, George; Tang, Chiu C.; Awaga, Kunio; Yang, Sihai; Schröder, Martin","Enhanced proton conductivity in a flexible metal-organic framework promoted by single-crystal-to-single-crystal transformation.","Chemical communications (Cambridge, England)","2021","57","1","65","68","10.1039/d0cc05270a","","","1.54184","CuKα","","0.1251","0.1003","","","0.2797","0.3038","","","","","","1.202","","","","has coordinates","261525","2021-02-04","22:27:40",""
"7127529","9.3908","0.0007","18.8473","0.0008","4.6739","0.0003","90","","118.995","0.005","90","","723.55","0.09","298","","298","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","Pb_based_MOF","- C8 H3 O4 Pb -","- C8 H3 O4 Pb -","- C32 H12 O16 Pb4 -","4","0.5","","Chen, Xi; Zhang, Zhongyue; Chen, Jin; Sapchenko, Sergei; Han, Xue; da-Silva, Ivan; Li, Ming; Vitorica-Yrezabal, Inigo J; Whitehead, George; Tang, Chiu C.; Awaga, Kunio; Yang, Sihai; Schröder, Martin","Enhanced proton conductivity in a flexible metal-organic framework promoted by single-crystal-to-single-crystal transformation.","Chemical communications (Cambridge, England)","2021","57","1","65","68","10.1039/d0cc05270a","powder diffraction","","0.824869","synchrotron","","0.775186","","","","","","","","1.55729","","","","","","","has coordinates","261525","2021-02-04","22:27:40",""
"7127530","16.0009","0.00004","9.969","0.00004","16.2184","0.00004","90","","108.181","0.004","90","","2457.89","0.06","115","","115","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H43 B Li O P -","- C24 H43 B Li O P -","- C96 H172 B4 Li4 O4 P4 -","4","1","","Ayyappan, Ramaraj; Coppel, Yannick; Vendier, Laure; Ghosh, Sundargopal; Sabo-Etienne, Sylviane; Bontemps, Sébastien","Synthesis and reactivity of phosphine borohydride compounds.","Chemical communications (Cambridge, England)","2021","57","3","375","378","10.1039/d0cc07072f","","","0.71073","MoKα","","0.0857","0.0511","","0.0946","0.0516","0.0478","","","","","","1.1052","","","","has coordinates","261574","2021-02-04","22:48:52",""
"7127531","10.2174","0.00002","10.9064","0.00003","15.0364","0.00003","77.67","0.003","74.617","0.003","87.944","0.003","1577.9","0.03","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H49 B Li O P -","- C34 H49 B Li O P -","- C68 H98 B2 Li2 O2 P2 -","2","1","","Ayyappan, Ramaraj; Coppel, Yannick; Vendier, Laure; Ghosh, Sundargopal; Sabo-Etienne, Sylviane; Bontemps, Sébastien","Synthesis and reactivity of phosphine borohydride compounds.","Chemical communications (Cambridge, England)","2021","57","3","375","378","10.1039/d0cc07072f","","","0.71073","MoKα","","0.0532","0.0532","","0.0831","0.0831","0.0727","","","","","","1.0732","","","","has coordinates","261574","2021-02-04","22:48:52",""
"7127532","7.7245","0.0002","11.1972","0.0004","21.3905","0.0001","90","","97.583","0.004","90","","1833.94","0.08","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H31 B P -","- C20 H31 B P -","- C80 H124 B4 P4 -","4","1","","Ayyappan, Ramaraj; Coppel, Yannick; Vendier, Laure; Ghosh, Sundargopal; Sabo-Etienne, Sylviane; Bontemps, Sébastien","Synthesis and reactivity of phosphine borohydride compounds.","Chemical communications (Cambridge, England)","2021","57","3","375","378","10.1039/d0cc07072f","","x-ray","0.71073","MoKα","","0.0834","0.0584","","","0.1578","0.1787","","","","","","1.124","","","","has coordinates,has disorder","261574","2021-02-04","22:48:52",""
"7127533","17.3854","0.0001","9.637","","21.4581","0.0001","90","","109.675","0.004","90","","3385.26","0.09","110","2","110","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H51 B Li O P -","- C38 H51 B Li O P -","- C152 H204 B4 Li4 O4 P4 -","4","1","","Ayyappan, Ramaraj; Coppel, Yannick; Vendier, Laure; Ghosh, Sundargopal; Sabo-Etienne, Sylviane; Bontemps, Sébastien","Synthesis and reactivity of phosphine borohydride compounds.","Chemical communications (Cambridge, England)","2021","57","3","375","378","10.1039/d0cc07072f","","","0.71073","MoKα","","0.0839","0.072","","","0.2155","0.224","","","","","","1.256","","","","has coordinates","261574","2021-02-04","22:48:52",""
"7127534","11.0929","0.000014","19.4758","0.00002","35.9239","0.00003","90","","90","","90","","7761.11","0.014","110","","110","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C80 H138 B2 Li2 O4 P2 -","- C80 H138 B2 Li2 O4 P2 -","- C320 H552 B8 Li8 O16 P8 -","4","1","","Ayyappan, Ramaraj; Coppel, Yannick; Vendier, Laure; Ghosh, Sundargopal; Sabo-Etienne, Sylviane; Bontemps, Sébastien","Synthesis and reactivity of phosphine borohydride compounds.","Chemical communications (Cambridge, England)","2021","57","3","375","378","10.1039/d0cc07072f","","","0.71073","MoKα","","0.0475","0.0475","","0.0439","0.0439","0.0434","","","","","","0.8344","","","","has coordinates","261574","2021-02-04","22:48:52",""
"7127540","9.7169","0.0008","10.6308","0.0006","11.537","0.0007","104.586","0.005","110.708","0.007","96.983","0.006","1049.22","0.14","294","","294","","","","","","","","","4","P -1","-P 1","2","","","","- C24 Au2 Cl10 F12 -","- C24 Au2 Cl10 F12 -","- C24 Au2 Cl10 F12 -","1","0.5","","Fernández-Moyano, Sara; Peñas-Defrutos, Marconi N; Bartolomé, Camino; Espinet, Pablo","Striking ligand-disproportionative Cl/aryl scrambling in a simple Au(III) system. Solvent role, driving forces and mechanisms.","Chemical communications (Cambridge, England)","2021","57","1","125","128","10.1039/d0cc06450e","","x-ray","0.71073","MoKα","","0.0518","0.034","","","0.0619","0.0689","","","","","","0.966","","","","has coordinates","261521","2021-02-04","22:25:46",""
"7127541","17.801","0.004","12.593","0.003","17.029","0.003","90","","116.43","0.02","90","","3418.4","1.4","294","","294","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H22 Au Cl6 F9 O3 -","- C26 H22 Au Cl6 F9 O3 -","- C104 H88 Au4 Cl24 F36 O12 -","4","0.5","","Fernández-Moyano, Sara; Peñas-Defrutos, Marconi N; Bartolomé, Camino; Espinet, Pablo","Striking ligand-disproportionative Cl/aryl scrambling in a simple Au(III) system. Solvent role, driving forces and mechanisms.","Chemical communications (Cambridge, England)","2021","57","1","125","128","10.1039/d0cc06450e","","x-ray","0.71073","MoKα","","0.1104","0.0617","","","0.1185","0.1419","","","","","","1.015","","","","has coordinates","261521","2021-02-04","22:25:47",""
"7127542","10.2702","0.0007","12.5565","0.0009","16.0292","0.0011","103.351","0.006","101.635","0.006","110.575","0.006","1789.9","0.3","294","","294","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H36 Au Cl6 F6 N -","- C28 H36 Au Cl6 F6 N -","- C56 H72 Au2 Cl12 F12 N2 -","2","1","","Fernández-Moyano, Sara; Peñas-Defrutos, Marconi N; Bartolomé, Camino; Espinet, Pablo","Striking ligand-disproportionative Cl/aryl scrambling in a simple Au(III) system. Solvent role, driving forces and mechanisms.","Chemical communications (Cambridge, England)","2021","57","1","125","128","10.1039/d0cc06450e","","","0.71073","MoKα","","0.0905","0.0467","","","0.0895","0.113","","","","","","1.017","","","","has coordinates","261521","2021-02-04","22:25:47",""
"7127543","9.7193","0.0006","12.2962","0.0007","15.3889","0.0009","100.005","0.005","97.584","0.005","99.628","0.005","1760.92","0.19","294","","294","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H36 Au Cl6 F6 N -","- C28 H36 Au Cl6 F6 N -","- C56 H72 Au2 Cl12 F12 N2 -","2","1","","Fernández-Moyano, Sara; Peñas-Defrutos, Marconi N; Bartolomé, Camino; Espinet, Pablo","Striking ligand-disproportionative Cl/aryl scrambling in a simple Au(III) system. Solvent role, driving forces and mechanisms.","Chemical communications (Cambridge, England)","2021","57","1","125","128","10.1039/d0cc06450e","","x-ray","0.71073","MoKα","","0.1057","0.0628","","","0.1468","0.1769","","","","","","1.024","","","","has coordinates","261521","2021-02-04","22:25:47",""
"7127544","18.9386","0.0007","18.9386","0.0007","12.733","0.0009","90","","90","","90","","4567","0.4","294","","294","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C40 H36 Au Cl8 F12 N -","- C40 H36 Au Cl8 F12 N -","- C160 H144 Au4 Cl32 F48 N4 -","4","0.25","","Fernández-Moyano, Sara; Peñas-Defrutos, Marconi N; Bartolomé, Camino; Espinet, Pablo","Striking ligand-disproportionative Cl/aryl scrambling in a simple Au(III) system. Solvent role, driving forces and mechanisms.","Chemical communications (Cambridge, England)","2021","57","1","125","128","10.1039/d0cc06450e","","x-ray","0.71073","MoKα","","0.0927","0.0535","","","0.0885","0.1013","","","","","","1.079","","","","has coordinates","261521","2021-02-04","22:25:47",""
"7127545","9.465","0.0002","23.2224","0.0004","9.3743","0.0001","90","","96.27","0.001","90","","2048.15","0.06","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H22 O2 -","- C28 H22 O2 -","- C112 H88 O8 -","4","1","","Abdollahi, Maryam F.; You, Jian; Wang, Tao; Zhao, Yuming","Molecular tuning of the crystallization-induced emission enhancement of diphenyl-dibenzofulvene luminogens.","Chemical communications (Cambridge, England)","2021","57","4","484","487","10.1039/d0cc07013k","","","1.54184","CuKα","","0.0779","0.0681","","","0.1795","0.1877","","","","","","1.0512","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127546","10.305","0.0002","10.305","0.0002","19.6103","0.0006","90","","90","","90","","2082.48","0.09","100","2","100","2","","","","","","","","3","P -4 21 c","P -4 2n","114","","","","- C28 H22 O2 -","- C28 H22 O2 -","- C112 H88 O8 -","4","0.5","","Abdollahi, Maryam F.; You, Jian; Wang, Tao; Zhao, Yuming","Molecular tuning of the crystallization-induced emission enhancement of diphenyl-dibenzofulvene luminogens.","Chemical communications (Cambridge, England)","2021","57","4","484","487","10.1039/d0cc07013k","","x-ray","1.54184","CuKα","","0.0817","0.0793","","","0.2009","0.2036","","","","","","1.104","","","","has coordinates","261540","2021-02-04","22:34:51",""
"7127547","5.7907","0.0004","34.727","0.002","18.7947","0.0013","90","","91.041","0.005","90","","3778.9","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H18 O2 -","- C27 H18 O2 -","- C216 H144 O16 -","8","2","","Abdollahi, Maryam F.; You, Jian; Wang, Tao; Zhao, Yuming","Molecular tuning of the crystallization-induced emission enhancement of diphenyl-dibenzofulvene luminogens.","Chemical communications (Cambridge, England)","2021","57","4","484","487","10.1039/d0cc07013k","","","1.54178","CuKα","","0.0818","0.0556","","","0.1336","0.1509","","","","","","1.033","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127548","9.865","0.0001","15.3404","0.0001","19.3137","0.0001","90","","90","","90","","2922.8","0.04","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C40 H30 O2 -","- C40 H30 O2 -","- C160 H120 O8 -","4","1","","Abdollahi, Maryam F.; You, Jian; Wang, Tao; Zhao, Yuming","Molecular tuning of the crystallization-induced emission enhancement of diphenyl-dibenzofulvene luminogens.","Chemical communications (Cambridge, England)","2021","57","4","484","487","10.1039/d0cc07013k","","x-ray","1.54184","CuKα","","0.034","0.032","","","0.0829","0.0842","","","","","","1.048","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127549","9.4767","0.0001","21.0834","0.0003","10.6676","0.0002","90","","107.812","0.0007","90","","2029.23","0.05","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 O2 -","- C28 H22 O2 -","- C112 H88 O8 -","4","1","","Abdollahi, Maryam F.; You, Jian; Wang, Tao; Zhao, Yuming","Molecular tuning of the crystallization-induced emission enhancement of diphenyl-dibenzofulvene luminogens.","Chemical communications (Cambridge, England)","2021","57","4","484","487","10.1039/d0cc07013k","","","1.54178","CuKα","","0.0392","0.0353","","","0.0971","0.1006","","","","","","1.088","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127550","9.7287","0.0001","10.5757","0.0002","15.2022","0.0003","109.07","0.002","102.442","0.001","90.391","0.001","1438.5","0.05","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C40 H30 O2 -","- C39.994 H29.995 O2 -","- C79.988 H59.99 O4 -","2","1","","Abdollahi, Maryam F.; You, Jian; Wang, Tao; Zhao, Yuming","Molecular tuning of the crystallization-induced emission enhancement of diphenyl-dibenzofulvene luminogens.","Chemical communications (Cambridge, England)","2021","57","4","484","487","10.1039/d0cc07013k","","x-ray","1.54184","CuKα","","0.0921","0.083","","","0.2427","0.254","","","","","","1.059","","","","has coordinates,has disorder","261540","2021-02-04","22:34:51",""
"7127551","7.156","0.0001","7.1296","0.0001","28.7875","0.0004","90","","92.485","0.001","90","","1467.34","0.04","100","2","100","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C40 H30 O2 -","- C40 H30 O2 -","- C80 H60 O4 -","2","1","","Abdollahi, Maryam F.; You, Jian; Wang, Tao; Zhao, Yuming","Molecular tuning of the crystallization-induced emission enhancement of diphenyl-dibenzofulvene luminogens.","Chemical communications (Cambridge, England)","2021","57","4","484","487","10.1039/d0cc07013k","","x-ray","1.54184","CuKα","","0.055","0.0517","","","0.1359","0.1387","","","","","","1.043","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127552","13.76217","0.00004","10.08021","0.00003","14.3837","0.00004","90","","90.2256","0.0003","90","","1995.37","0.01","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 O2 -","- C28 H22 O2 -","- C112 H88 O8 -","4","1","","Abdollahi, Maryam F.; You, Jian; Wang, Tao; Zhao, Yuming","Molecular tuning of the crystallization-induced emission enhancement of diphenyl-dibenzofulvene luminogens.","Chemical communications (Cambridge, England)","2021","57","4","484","487","10.1039/d0cc07013k","","x-ray","1.54184","CuKα","","0.0364","0.0357","","","0.0912","0.0918","","","","","","1.077","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127553","12.994","0.014","32.99","0.03","13.281","0.014","90","","102.381","0.016","90","","5561","10","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(5,10,15-Triphenyl-tetrabenzocorrolato)Cu hexachloroantimonate","","- C53 H31 Cl6 Cu N4 Sb -","- C53 H31 Cl6 Cu N4 Sb -","- C212 H124 Cl24 Cu4 N16 Sb4 -","4","1","","Wu, Fan; Xu, Jialiang; Gao, Hu; Li, Chenhong; Xu, Shuai; Uno, Hidemitsu; Xu, Yan; Zhao, Yue; Shen, Zhen","A cationic benzocorrole Cu(II) complex as a highly stable antiaromatic system.","Chemical communications (Cambridge, England)","2021","57","3","383","386","10.1039/d0cc06703b","","","0.71073","MoKα","","0.1194","0.0623","","","0.1724","0.1906","","","","","","1.025","","","","has coordinates,has disorder","261573","2021-02-04","22:48:27",""
"7127554","4.2604","0.0002","7.858","0.0004","30.3127","0.0014","90","","90","","90","","1014.82","0.08","100","","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H11 Br N O -","- C11 H11 Br N O -","- C44 H44 Br4 N4 O4 -","4","1","","Ye, Xiang-Yu; Liang, Zhi-Qin; Jin, Cong; Lang, Qi-Wei; Chen, Gen-Qiang; Zhang, Xumu","Design of oxa-spirocyclic PHOX ligands for the asymmetric synthesis of lorcaserin via iridium-catalyzed asymmetric hydrogenation.","Chemical communications (Cambridge, England)","2021","57","2","195","198","10.1039/d0cc06311h","","x-ray","0.71073","MoKα","","0.0326","0.0304","","","0.0706","0.0714","","","","","","1.076","","","","has coordinates","261546","2021-02-04","22:36:54",""
"7127555","10.3636","0.0009","11.322","0.001","17.7474","0.0015","80.786","0.002","73.318","0.002","89.103","0.002","1968","0.3","200","2","200","","","","","","","","","6","P 1","P 1","1","","","","- C36 H25 Br2 N3 O3 S -","- C36 H25 Br2 N3 O3 S -","- C72 H50 Br4 N6 O6 S2 -","2","2","","Wang, Wenyao; Bao, Xiaoze; Wei, Shiqiang; Nawaz, Shah; Qu, Jingping; Wang, Baomin","Asymmetric sequential annulation/aldol process of 4-isothiocyanato pyrazolones and allenones: access to novel spiro[pyrrole-pyrazolones] and spiro[thiopyranopyrrole-pyrazolones].","Chemical communications (Cambridge, England)","2021","57","3","363","366","10.1039/d0cc07113g","","","0.71073","MoKα","","0.099","0.0541","","","0.1244","0.1401","","","","","","0.984","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127556","12.5755","0.0011","10.6535","0.0009","13.6818","0.0012","90","","115.503","0.002","90","","1654.4","0.2","297","","297","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36 H25 Br2 N3 O3 S -","- C36 H25 Br2 N3 O3 S -","- C72 H50 Br4 N6 O6 S2 -","2","1","","Wang, Wenyao; Bao, Xiaoze; Wei, Shiqiang; Nawaz, Shah; Qu, Jingping; Wang, Baomin","Asymmetric sequential annulation/aldol process of 4-isothiocyanato pyrazolones and allenones: access to novel spiro[pyrrole-pyrazolones] and spiro[thiopyranopyrrole-pyrazolones].","Chemical communications (Cambridge, England)","2021","57","3","363","366","10.1039/d0cc07113g","","","0.71073","MoKα","","0.134","0.054","","","0.0775","0.0955","","","","","","0.99","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127557","19.6936","0.0002","38.3273","0.0003","27.2035","0.0003","90","","97.466","0.001","90","","20359.2","0.3","130","2","130","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C176 H176 N32 O28 S2 -","- C176 H176 N32 O28 S2 -","- C704 H704 N128 O112 S8 -","4","1","","Pramanik, Susnata; Kauffmann, Brice; Hecht, Stefan; Ferrand, Yann; Huc, Ivan","Light-mediated chiroptical switching of an achiral foldamer host in presence of a carbohydrate guest.","Chemical communications (Cambridge, England)","2021","57","1","93","96","10.1039/d0cc06484j","","","1.54184","CuKα","","0.0908","0.0852","","","0.241","0.2463","","","","","","1.029","","","","has coordinates,has disorder","261524","2021-02-04","22:27:08",""
"7127558","19.9465","0.0007","20.6535","0.0006","29.53","0.0009","70.68","0.003","82.045","0.003","68.219","0.003","10659","0.7","130","","130","2","","","","","","","","9","P -1","-P 1","2","","","","- C199 H226 Cl4 F6 Mg N32 O27 P S2 -","- C199 H225.999 Cl4 F6 Mg N32 O27 P S2 -","- C397.999 H451.999 Cl8 F12 Mg2 N64 O54 P2 S4 -","2","1","","Pramanik, Susnata; Kauffmann, Brice; Hecht, Stefan; Ferrand, Yann; Huc, Ivan","Light-mediated chiroptical switching of an achiral foldamer host in presence of a carbohydrate guest.","Chemical communications (Cambridge, England)","2021","57","1","93","96","10.1039/d0cc06484j","","","1.54184","CuKα","","0.1309","0.0909","","","0.2589","0.2991","","","","","","1.046","","","","has coordinates,has disorder","261524","2021-02-04","22:27:08",""
"7127559","39.9797","0.0006","39.0226","0.0004","35.4973","0.0005","90","","110.728","0.002","90","","51795.1","1.4","130","2","130","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C215 H229 N40 O37 S4.5 -","- C215 H229 N40 O37 S4.5 -","- C1720 H1832 N320 O296 S36 -","8","2","","Pramanik, Susnata; Kauffmann, Brice; Hecht, Stefan; Ferrand, Yann; Huc, Ivan","Light-mediated chiroptical switching of an achiral foldamer host in presence of a carbohydrate guest.","Chemical communications (Cambridge, England)","2021","57","1","93","96","10.1039/d0cc06484j","","","1.54178","CuKα","","0.1611","0.1189","","","0.3485","0.3867","","","","","","1.391","","","","has coordinates","295862","2024-11-09","12:08:11",""
"7127560","19.7417","0.0004","8.2997","0.0002","41.8665","0.001","90","","90","","90","","6859.8","0.3","150","","150","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C29 H34 F12 N4 O4 P2 -","- C29 H34 F12 N4 O4 P2 -","- C232 H272 F96 N32 O32 P16 -","8","2","","Serpell, Christopher J.; Park, Ah Young; Robinson, Carol V.; Beer, Paul D.","Imidazolium-based catenane host for bromide recognition in aqueous media.","Chemical communications (Cambridge, England)","2021","57","1","101","104","10.1039/d0cc06299e","","","0.71073","MoKα","","0.1118","0.0739","","0.1934","0.1673","0.1934","","","","","","0.9123","","","","has coordinates","261527","2021-02-04","22:28:15",""
"7127561","22.115","0.002","8.2941","0.0008","17.1145","0.0016","90","","93.599","0.005","90","","3133","0.5","150","","150","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H34 Cl F6 N4 O4 P -","- C29 H34 Cl F6 N4 O4 P -","- C116 H136 Cl4 F24 N16 O16 P4 -","4","1","","Serpell, Christopher J.; Park, Ah Young; Robinson, Carol V.; Beer, Paul D.","Imidazolium-based catenane host for bromide recognition in aqueous media.","Chemical communications (Cambridge, England)","2021","57","1","101","104","10.1039/d0cc06299e","","","0.71073","MoKα","","0.0994","0.0747","","0.1718","0.1368","0.1707","","","","","","1.2674","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127562","24.685","0.0004","6.8709","0.0001","19.9436","0.0003","90","","97.1114","0.0006","90","","3356.58","0.09","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27.72 H31.44 F12 N4 O4.24 P2 -","- C27.72 H31.44 F12 N4 O4.24 P2 -","- C110.88 H125.76 F48 N16 O16.96 P8 -","4","1","","Serpell, Christopher J.; Park, Ah Young; Robinson, Carol V.; Beer, Paul D.","Imidazolium-based catenane host for bromide recognition in aqueous media.","Chemical communications (Cambridge, England)","2021","57","1","101","104","10.1039/d0cc06299e","","","0.71073","MoKα","","0.0976","0.0866","","0.2568","0.2459","0.2568","","","","","","1.0445","","","","has coordinates,has disorder","261527","2021-02-04","22:28:15",""
"7127563","14.1019","0.0016","19.733","0.002","21.198","0.002","101.081","0.003","101.266","0.003","100.857","0.003","5518.7","1","150","2","150","2","","","","","","","","7","P -1","-P 1","2","Co_tBudhbpy_py2_PF6","","","- C96 H112 Co2 F12 N8 O4 P2 -","- C96 H112 Co2 F12 N8 O4 P2 -","- C192 H224 Co4 F24 N16 O8 P4 -","2","1","","Nichols, Asa W.; Kuehner, Joseph S.; Huffman, Brittany L.; Miedaner, Peter R.; Dickie, Diane A.; Machan, Charles W.","Reduction of dioxygen to water by a Co(N<sub>2</sub>O<sub>2</sub>) complex with a 2,2'-bipyridine backbone.","Chemical communications (Cambridge, England)","2021","57","4","516","519","10.1039/d0cc06763f","","","0.71073","MoKα","","0.1465","0.0607","","","0.1525","0.1928","","","","","","0.962","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127564","7.834","0.0005","11.7432","0.0007","12.8374","0.0007","77.393","0.001","87.052","0.001","82.229","0.002","1141.64","0.12","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H36 Cl4 N8 O18 Ru2 S6 -","- C24 H42.364 Cl4 N8 O18 Ru2 S6 -","- C24 H42.364 Cl4 N8 O18 Ru2 S6 -","1","0.5","","Cole, Jacqueline M.; Gosztola, David J.; Velazquez-Garcia, Jose de J; Grass Wang, SuYin; Chen, Yu-Sheng","Rapid build up of nanooptomechanical transduction in single crystals of a ruthenium-based SO<sub>2</sub> linkage photoisomer.","Chemical communications (Cambridge, England)","2021","57","11","1320","1323","10.1039/d0cc06755e","","","0.41328","synchrotron","","0.0632","0.0432","","","0.0967","0.1018","","","","","","0.969","","","","has coordinates,has disorder","262511","2021-03-05","01:23:53",""
"7127565","7.8469","0.0008","11.8085","0.0013","12.8063","0.0013","77.427","0.002","87.258","0.002","82.259","0.002","1147.4","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H44 Cl4 N8 O18 Ru2 S6 -","- C24 H44 Cl4 N8 O18 Ru2 S6 -","- C24 H44 Cl4 N8 O18 Ru2 S6 -","1","0.5","","Cole, Jacqueline M.; Gosztola, David J.; Velazquez-Garcia, Jose de J; Grass Wang, SuYin; Chen, Yu-Sheng","Rapid build up of nanooptomechanical transduction in single crystals of a ruthenium-based SO<sub>2</sub> linkage photoisomer.","Chemical communications (Cambridge, England)","2021","57","11","1320","1323","10.1039/d0cc06755e","","","0.41328","synchrotron","","0.0728","0.0426","","","0.0998","0.106","","","","","","0.876","","","","has coordinates,has disorder","262511","2021-03-05","01:23:53",""
"7127566","11.6645","0.0007","10.8473","0.0007","18.382","0.0011","90","","97.004","0.004","90","","2308.5","0.2","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H21 Cl N2 O4 -","- C27 H21 Cl N2 O4 -","- C108 H84 Cl4 N8 O16 -","4","1","","Xie, Lihua; Li, Yi; Dong, Shunxi; Feng, Xiaoming; Liu, Xiaohua","Catalytic asymmetric formal [3+2] cycloaddition of isatogens with azlactones to construct indolin-3-one derivatives.","Chemical communications (Cambridge, England)","2021","57","2","239","242","10.1039/d0cc06418a","","","1.54178","CuKα","","0.1384","0.0844","","","0.2334","0.2974","","","","","","0.997","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127567","13.5867","0.0011","4.3673","0.0004","16.8442","0.0012","90","","104.545","0.008","90","","967.45","0.14","100","0.2","100","0.2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H19 F O2 -","- C27 H19 F O2 -","- C54 H38 F2 O4 -","2","1","","Jiang, Xinhang; Li, En; Chen, Jiean; Huang, Yong","Photo-induced energy transfer relay of N-heterocyclic carbene catalysis: an asymmetric α-fluorination/isomerization cascade.","Chemical communications (Cambridge, England)","2021","57","6","729","732","10.1039/d0cc07264h","","x-ray","1.54184","CuKα","","0.0997","0.0973","","","0.2945","0.2962","","","","","","1.065","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127568","12.7081","0.0005","13.651","0.0005","19.4888","0.0008","79.924","0.003","82.227","0.004","81.65","0.003","3272.4","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H98 B3 N4 O4 Y -","- C66 H98 B3 N4 O4 Y -","- C132 H196 B6 N8 O8 Y2 -","2","1","","Thomas-Hargreaves, Lewis R; Hunger, David; Kern, Michal; Wooles, Ashley J.; van Slageren, Joris; Chilton, Nicholas F.; Liddle, Stephen T.","Insights into <i>D</i><sub>4h</sub>@metal-symmetry single-molecule magnetism: the case of a dysprosium-bis(boryloxide) complex.","Chemical communications (Cambridge, England)","2021","57","6","733","736","10.1039/d0cc07446b","","x-ray","0.71073","MoKα","","0.1122","0.0658","","","0.1533","0.1821","","","","","","1.033","","","","has coordinates","261551","2021-02-04","22:38:49",""
"7127569","12.9871","0.0005","27.1689","0.0011","24.3048","0.0011","90","","93.672","0.004","90","","8558.2","0.6","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C92 H124 B3 N4 O6 Y -","- C92 H124 B3 N4 O6 Y -","- C368 H496 B12 N16 O24 Y4 -","4","1","","Thomas-Hargreaves, Lewis R; Hunger, David; Kern, Michal; Wooles, Ashley J.; van Slageren, Joris; Chilton, Nicholas F.; Liddle, Stephen T.","Insights into <i>D</i><sub>4h</sub>@metal-symmetry single-molecule magnetism: the case of a dysprosium-bis(boryloxide) complex.","Chemical communications (Cambridge, England)","2021","57","6","733","736","10.1039/d0cc07446b","","x-ray","0.71073","MoKα","","0.117","0.0593","","","0.0987","0.1153","","","","","","1.04","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127570","23.5114","0.0003","19.5012","0.0003","19.881","0.0003","90","","90","","90","","9115.4","0.2","150","2","150","2","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C98 H130 B3 Dy N4 O6 -","- C97.5 H130 B3 Dy N4 O6 -","- C390 H520 B12 Dy4 N16 O24 -","4","0.25","","Thomas-Hargreaves, Lewis R; Hunger, David; Kern, Michal; Wooles, Ashley J.; van Slageren, Joris; Chilton, Nicholas F.; Liddle, Stephen T.","Insights into <i>D</i><sub>4h</sub>@metal-symmetry single-molecule magnetism: the case of a dysprosium-bis(boryloxide) complex.","Chemical communications (Cambridge, England)","2021","57","6","733","736","10.1039/d0cc07446b","","x-ray","0.71073","MoKα","","0.0672","0.0629","","","0.1322","0.1342","","","","","","1.181","","","","has coordinates,has disorder","261551","2021-02-04","22:38:51",""
"7127571","12.7769","0.0007","13.6689","0.0007","19.8264","0.0015","107.413","0.006","92.621","0.005","98.825","0.004","3249.4","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H98 B3 Dy N4 O4 -","- C66 H98 B3 Dy N4 O4 -","- C132 H196 B6 Dy2 N8 O8 -","2","1","","Thomas-Hargreaves, Lewis R; Hunger, David; Kern, Michal; Wooles, Ashley J.; van Slageren, Joris; Chilton, Nicholas F.; Liddle, Stephen T.","Insights into <i>D</i><sub>4h</sub>@metal-symmetry single-molecule magnetism: the case of a dysprosium-bis(boryloxide) complex.","Chemical communications (Cambridge, England)","2021","57","6","733","736","10.1039/d0cc07446b","","x-ray","0.71073","MoKα","","0.1541","0.1325","","","0.3221","0.3354","","","","","","1.119","","","","has coordinates","261551","2021-02-04","22:38:51",""
"7127572","8.5337","0.0013","10.2008","0.0013","11.672","0.002","90.88","0.014","110.076","0.016","114.477","0.014","853.7","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H18 N2 O3 -","- C20 H18 N2 O3 -","- C40 H36 N4 O6 -","2","1","","Pawar, Amol Prakash; Yadav, Jyothi; Mir, Nisar Ahmad; Iype, Eldhose; Rangan, Krishnan; Anthal, Sumati; Kant, Rajni; Kumar, Indresh","Direct catalytic synthesis of β-(C3)-substituted pyrroles: a complementary addition to the Paal-Knorr reaction.","Chemical communications (Cambridge, England)","2021","57","2","251","254","10.1039/d0cc06357f","","","0.71073","MoKα","","0.1945","0.1639","","","0.4595","0.4779","","","","","","1.616","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127573","10.8918","0.0002","10.9673","0.0002","11.9061","0.0003","90","","102.324","0.002","90","","1389.45","0.05","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C64 H72 N8 O8 -","4","1","","Pawar, Amol Prakash; Yadav, Jyothi; Mir, Nisar Ahmad; Iype, Eldhose; Rangan, Krishnan; Anthal, Sumati; Kant, Rajni; Kumar, Indresh","Direct catalytic synthesis of β-(C3)-substituted pyrroles: a complementary addition to the Paal-Knorr reaction.","Chemical communications (Cambridge, England)","2021","57","2","251","254","10.1039/d0cc06357f","","x-ray","1.54184","CuKα","","0.0433","0.04","","","0.1058","0.1088","","","","","","1.056","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127574","11.2879","0.0002","7.2732","0.0001","19.0032","0.0003","90","","103.46","0.002","90","","1517.29","0.04","93","2","93","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H16 N2 O2 -","- C19 H16 N2 O2 -","- C76 H64 N8 O8 -","4","1","","Pawar, Amol Prakash; Yadav, Jyothi; Mir, Nisar Ahmad; Iype, Eldhose; Rangan, Krishnan; Anthal, Sumati; Kant, Rajni; Kumar, Indresh","Direct catalytic synthesis of β-(C3)-substituted pyrroles: a complementary addition to the Paal-Knorr reaction.","Chemical communications (Cambridge, England)","2021","57","2","251","254","10.1039/d0cc06357f","","x-ray","1.54184","CuKα","","0.0475","0.0442","","","0.1187","0.1213","","","","","","1.082","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127575","10.3","0.0014","13.359","0.0018","10.7467","0.0014","90","","103.88","0.005","90","","1435.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O3 -","- C16 H15 N3 O3 -","- C64 H60 N12 O12 -","4","1","","Saha, Debarshi; Taily, Irshad Maajid; Naik, Sumitra; Banerjee, Prabal","Electrochemical access to benzimidazolone and quinazolinone derivatives <i>via in situ</i> generation of isocyanates.","Chemical communications (Cambridge, England)","2021","57","5","631","634","10.1039/d0cc07125k","","","0.71073","MoKα","","0.1051","0.052","","","0.133","0.1679","","","","","","1.028","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127576","5.0971","0.0006","5.3649","0.0007","12.3429","0.0016","99.966","0.005","96.111","0.004","90.897","0.004","330.34","0.07","293","2","293","2","","","","","","","","4","P 1","P 1","1","","","","- C15 H13 N3 O3 -","- C15 H13 N3 O3 -","- C15 H13 N3 O3 -","1","1","","Saha, Debarshi; Taily, Irshad Maajid; Naik, Sumitra; Banerjee, Prabal","Electrochemical access to benzimidazolone and quinazolinone derivatives <i>via in situ</i> generation of isocyanates.","Chemical communications (Cambridge, England)","2021","57","5","631","634","10.1039/d0cc07125k","","","0.71073","MoKα","","0.0855","0.0722","","","0.1853","0.2058","","","","","","1.066","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127577","8.2512","0.0012","10.4301","0.0014","15.81","0.002","80.059","0.006","79.541","0.006","87.359","0.006","1317.8","0.3","300","2","300","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H27 Cl0 N3 O3 -","- C25 H27 N3 O3 -","- C50 H54 N6 O6 -","2","1","","Ranjani, Ganapathy; Nagarajan, Rajagopal","Access to 1-indolyltetrahydro-β-carbolines via metal-free cross-dehydrogenative coupling: the total synthesis of eudistomin U, isoeudistomin U and 19-bromoisoeudistomin U.","Chemical communications (Cambridge, England)","2021","57","6","757","760","10.1039/d0cc06958b","","","0.71073","MoKα","","0.2127","0.0916","","","0.2604","0.322","","","","","","0.884","","","","has coordinates","261548","2021-02-04","22:37:12",""
"7127578","11.0339","0.0009","8.5608","0.0004","27.529","0.002","90","","99.793","0.005","90","","2562.5","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H42 Bi3 I15 N6 -","- C12 H42 Bi3 I15 N6 -","- C24 H84 Bi6 I30 N12 -","2","1","","Liu, Yu-Hua; Peng, Hang; Liao, Wei-Qiang","A lead-free bismuth iodide organic-inorganic ferroelectric semiconductor.","Chemical communications (Cambridge, England)","2021","57","5","647","650","10.1039/d0cc07443h","","","0.71073","MoKα","","0.0701","0.0528","","","0.0875","0.0949","","","","","","1.001","","","","has coordinates","261537","2021-02-04","22:33:30",""
"7127579","11.18","0.005","8.575","0.004","27.548","0.013","90","","100.185","0.01","90","","2599","2","383","2","383","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C12 H42 Bi3 I15 N6 -","- C12 H42 Bi3 I15 N6 -","- C24 H84 Bi6 I30 N12 -","2","0.5","","Liu, Yu-Hua; Peng, Hang; Liao, Wei-Qiang","A lead-free bismuth iodide organic-inorganic ferroelectric semiconductor.","Chemical communications (Cambridge, England)","2021","57","5","647","650","10.1039/d0cc07443h","","","0.71073","MoKα","","0.0901","0.0725","","","0.1446","0.1557","","","","","","1.002","","","","has coordinates","261537","2021-02-04","22:33:31",""
"7127580","16.8465","0.0011","7.9802","0.0005","14.5677","0.0015","90","","118.616","0.001","90","","1719.2","0.2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[(C6H11NC)2Au]PF6","","","- C14 H22 Au F6 N2 P -","- C14 H22 Au F6 N2 P -","- C56 H88 Au4 F24 N8 P4 -","4","0.5","","Luong, Lucy M. C.; Olmstead, Marilyn M.; Balch, Alan L.","A non-luminescent polymorph of [(cyclohexyl isocyanide)<sub>2</sub>Au]PF<sub>6</sub> that becomes luminescent upon grinding or exposure to dichloromethane vapor.","Chemical communications (Cambridge, England)","2021","57","6","793","796","10.1039/d0cc06161a","","","0.71073","MoKα","","0.0128","0.0128","","","0.0315","0.0315","","","","","","1.208","","","","has coordinates","261555","2021-02-04","22:41:00",""
"7127581","6.9526","0.0002","11.2186","0.0003","17.4355","0.0005","88.79","0.002","85.798","0.002","79.513","0.002","1333.59","0.07","173","1","173","1","","","","","","","","5","P -1","-P 1","2","","","","- C7 H11 N8 O5.5 S -","- C7 H11 N8 O5.5 S -","- C28 H44 N32 O22 S4 -","4","2","","Hu, Lu; Staples, Richard J.; Shreeve, Jean'ne M.","Hydrogen bond system generated by nitroamino rearrangement: new character for designing next generation energetic materials.","Chemical communications (Cambridge, England)","2021","57","5","603","606","10.1039/d0cc07101c","","","1.54178","CuKα","","0.0372","0.0344","","","0.092","0.0944","","","","","","1.065","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127582","16.1653","0.0014","8.6116","0.0007","18.798","0.0016","90","","111.557","0.001","90","","2433.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 N2 O4 S2 -","- C26 H26 N2 O4 S2 -","- C104 H104 N8 O16 S8 -","4","1","","Gurram, Ravikumar; Nanubolu, Jagadeesh Babu; Menon, Rajeev S.","Rapid synthesis of azepinoindole derivatives from tryptamine sulfonamides and bromoallyl sulfones <i>via</i> an acid-mediated cyclization and rearrangement.","Chemical communications (Cambridge, England)","2021","57","5","635","638","10.1039/d0cc06991d","","","0.71073","MoKα","","0.0748","0.0488","","","0.1137","0.1296","","","","","","1.014","","","","has coordinates,has disorder","261533","2021-02-04","22:30:39",""
"7127583","12.745","0.003","8.2887","0.0017","20.697","0.004","90","","104.665","0.003","90","","2115.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H24 N2 O4 S2 -","- C21 H24 N2 O4 S2 -","- C84 H96 N8 O16 S8 -","4","1","","Gurram, Ravikumar; Nanubolu, Jagadeesh Babu; Menon, Rajeev S.","Rapid synthesis of azepinoindole derivatives from tryptamine sulfonamides and bromoallyl sulfones <i>via</i> an acid-mediated cyclization and rearrangement.","Chemical communications (Cambridge, England)","2021","57","5","635","638","10.1039/d0cc06991d","","","0.71073","MoKα","","0.0563","0.0524","","","0.1306","0.1333","","","","","","1.152","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127584","14.0404","0.0004","14.6915","0.0004","19.3746","0.0006","110.013","0.002","103.982","0.002","95.768","0.001","3569.6","0.19","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C76 H68 Fe N20 O4 P2 -","- C76 H68 Fe N20 O4 P2 -","- C152 H136 Fe2 N40 O8 P4 -","2","1","","Su, Qian-Qian; Yuan, Qiong; Wu, Xiao-Fan; Chen, Si-Huai; Xiang, Jing; Jin, Xin-Xin; Wang, Li-Xin; Wang, Bing-Wu; Gao, Song; Lau, Tai-Chu","Slow magnetic relaxation in structurally similar mononuclear 8-coordinate Fe(II) and Fe(III) compounds.","Chemical communications (Cambridge, England)","2021","57","6","781","784","10.1039/d0cc07004a","","","1.54178","CuKα","","0.1387","0.1127","","","0.3116","0.3434","","","","","","1.201","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127585","19.6724","0.0007","7.939","0.0002","30.9185","0.001","90","","94.775","0.003","90","","4812.1","0.3","100","0.1","100","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C49 H36 Fe N20 O P -","- C49 H36 Fe N20 O P -","- C196 H144 Fe4 N80 O4 P4 -","4","1","","Su, Qian-Qian; Yuan, Qiong; Wu, Xiao-Fan; Chen, Si-Huai; Xiang, Jing; Jin, Xin-Xin; Wang, Li-Xin; Wang, Bing-Wu; Gao, Song; Lau, Tai-Chu","Slow magnetic relaxation in structurally similar mononuclear 8-coordinate Fe(II) and Fe(III) compounds.","Chemical communications (Cambridge, England)","2021","57","6","781","784","10.1039/d0cc07004a","","","0.71073","MoKα","","0.0911","0.0551","","","0.1468","0.1973","","","","","","0.665","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127586","12.2527","0.0003","18.7361","0.0005","25.0944","0.0007","90","","94.729","0.002","90","","5741.3","0.3","119.99","0.1","119.99","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C61 H69 Au N2 O4 P2 -","- C61 H69 Au N2 O4 P2 -","- C244 H276 Au4 N8 O16 P8 -","4","1","","Dhara, Debabrata; Scheschkewitz, David; Chandrasekhar, Vadapalli; Yildiz, Cem B.; Jana, Anukul","Reactivity of NHC/diphosphene-coordinated Au(I)-hydride.","Chemical communications (Cambridge, England)","2021","57","6","809","812","10.1039/d0cc05461e","","x-ray","0.71073","MoKα","","0.0552","0.0445","","","0.0941","0.0979","","","","","","1.046","","","","has coordinates","261549","2021-02-04","22:38:03",""
"7127587","17.382","0.0009","17.2777","0.0007","20.8054","0.0011","90","","112.32","0.006","90","","5780.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C63 H67 Au N2 P2 -","- C63 H67 Au N2 P2 -","- C252 H268 Au4 N8 P8 -","4","1","","Dhara, Debabrata; Scheschkewitz, David; Chandrasekhar, Vadapalli; Yildiz, Cem B.; Jana, Anukul","Reactivity of NHC/diphosphene-coordinated Au(I)-hydride.","Chemical communications (Cambridge, England)","2021","57","6","809","812","10.1039/d0cc05461e","","x-ray","0.71073","MoKα","","0.0789","0.0515","","","0.1022","0.11","","","","","","1.022","","","","has coordinates","261549","2021-02-04","22:38:03",""
"7127588","18.5661","0.0006","16.4929","0.0005","18.7879","0.0007","90","","109.411","0.004","90","","5426","0.3","119.97","0.1","119.97","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C59 H69 Au N4 O2 P2 -","- C59 H69 Au N4 O2 P2 -","- C236 H276 Au4 N16 O8 P8 -","4","1","","Dhara, Debabrata; Scheschkewitz, David; Chandrasekhar, Vadapalli; Yildiz, Cem B.; Jana, Anukul","Reactivity of NHC/diphosphene-coordinated Au(I)-hydride.","Chemical communications (Cambridge, England)","2021","57","6","809","812","10.1039/d0cc05461e","","x-ray","0.71073","MoKα","","0.0918","0.0673","","","0.1674","0.1768","","","","","","1.062","","","","has coordinates","261549","2021-02-04","22:38:03",""
"7127589","11.8644","0.0002","21.3145","0.0004","26.4459","0.0006","80.844","0.002","81.813","0.002","86.997","0.002","6532.2","0.2","120.02","0.1","120.02","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C73 H79 Au N4 P2 -","- C73 H79 Au N4 P2 -","- C292 H316 Au4 N16 P8 -","4","2","","Dhara, Debabrata; Scheschkewitz, David; Chandrasekhar, Vadapalli; Yildiz, Cem B.; Jana, Anukul","Reactivity of NHC/diphosphene-coordinated Au(I)-hydride.","Chemical communications (Cambridge, England)","2021","57","6","809","812","10.1039/d0cc05461e","","x-ray","0.71073","MoKα","","0.0729","0.0438","","","0.0749","0.0803","","","","","","1.032","","","","has coordinates","295862","2024-11-09","12:08:11",""
"7127592","11.4729","0.0006","13.1325","0.0007","14.8881","0.0008","94.418","0.001","98.352","0.001","95.866","0.002","2198.1","0.2","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C45 H69 As3 -","- C45 H69 As3 -","- C90 H138 As6 -","2","1","","Schumann, André; Bresien, Jonas; Fischer, Malte; Hering-Junghans, Christian","Aryl-substituted triarsiranes: synthesis and reactivity.","Chemical communications (Cambridge, England)","2021","57","8","1014","1017","10.1039/d0cc07533g","","","1.54178","CuKα","","0.0223","0.0215","","","0.0566","0.0573","","","","","","1.035","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127593","18.7002","0.0003","11.2416","0.0002","17.3895","0.0003","90","","90","","90","","3655.62","0.11","150","2","150","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C40 H56 As2 Ti -","- C40 H56 As2 Ti -","- C160 H224 As8 Ti4 -","4","0.5","","Schumann, André; Bresien, Jonas; Fischer, Malte; Hering-Junghans, Christian","Aryl-substituted triarsiranes: synthesis and reactivity.","Chemical communications (Cambridge, England)","2021","57","8","1014","1017","10.1039/d0cc07533g","","","1.54178","CuKα","","0.0247","0.0235","","","0.0628","0.0644","","","","","","1.033","","","","has coordinates","261529","2021-02-04","22:29:34",""
"7127594","11.4194","0.0006","11.4914","0.0006","19.9143","0.0011","90","","93.483","0.001","90","","2608.4","0.2","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C64 H60 As2 D6 Ti -","- C64 H66 As2 Ti -","- C128 H132 As4 Ti2 -","2","1","","Schumann, André; Bresien, Jonas; Fischer, Malte; Hering-Junghans, Christian","Aryl-substituted triarsiranes: synthesis and reactivity.","Chemical communications (Cambridge, England)","2021","57","8","1014","1017","10.1039/d0cc07533g","","","0.71073","MoKα","","0.0314","0.027","","","0.0614","0.0633","","","","","","1.036","","","","has coordinates","261529","2021-02-04","22:29:34",""
"7127595","36.358","0.007","9.3907","0.0019","15.843","0.003","90","","91.12","0.03","90","","5408.2","1.8","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26.5 H45 As N2 -","- C24 H39 As N2 -","- C192 H312 As8 N16 -","8","1","","Schumann, André; Bresien, Jonas; Fischer, Malte; Hering-Junghans, Christian","Aryl-substituted triarsiranes: synthesis and reactivity.","Chemical communications (Cambridge, England)","2021","57","8","1014","1017","10.1039/d0cc07533g","","","0.71073","MoKα","","0.0512","0.032","","","0.0743","0.0783","","","","","","0.855","","","","has coordinates","261529","2021-02-04","22:29:34",""
"7127596","12.0242","0.0012","19.595","0.002","13.3094","0.0014","90","","100.25","0.0018","90","","3085.8","0.5","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H44 As2 Ti -","- C34 H44 As2 Ti -","- C136 H176 As8 Ti4 -","4","1","","Schumann, André; Bresien, Jonas; Fischer, Malte; Hering-Junghans, Christian","Aryl-substituted triarsiranes: synthesis and reactivity.","Chemical communications (Cambridge, England)","2021","57","8","1014","1017","10.1039/d0cc07533g","","","0.71073","MoKα","","0.0448","0.0282","","","0.0569","0.0625","","","","","","1.005","","","","has coordinates,has disorder","261529","2021-02-04","22:29:34",""
"7127597","9.2425","0.0013","9.2425","0.0013","22.02","0.004","90","","90","","120","","1629","0.4","150","2","150","2","","","","","","","","4","P 32","P 32","145","","","","- C22 H35 As N2 -","- C22 H35 As N2 -","- C66 H105 As3 N6 -","3","1","","Schumann, André; Bresien, Jonas; Fischer, Malte; Hering-Junghans, Christian","Aryl-substituted triarsiranes: synthesis and reactivity.","Chemical communications (Cambridge, England)","2021","57","8","1014","1017","10.1039/d0cc07533g","","","0.71073","MoKα","","0.0421","0.0286","","","0.0518","0.054","","","","","","0.837","","","","has coordinates","261529","2021-02-04","22:29:34",""
"7127598","11.6003","0.0005","18.1155","0.0007","16.171","0.0006","90","","91.336","0.001","90","","3397.3","0.2","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C36 H51 As3 -","- C36 H51 As3 -","- C144 H204 As12 -","4","1","","Schumann, André; Bresien, Jonas; Fischer, Malte; Hering-Junghans, Christian","Aryl-substituted triarsiranes: synthesis and reactivity.","Chemical communications (Cambridge, England)","2021","57","8","1014","1017","10.1039/d0cc07533g","","","0.71073","MoKα","","0.0341","0.0249","","","0.0581","0.0614","","","","","","1.026","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127603","8.7568","0.0003","16.7646","0.0006","17.6194","0.0006","90","","90","","90","","2586.6","0.16","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H25 F7 N2 O4 -","- C25 H25 F7 N2 O4 -","- C100 H100 F28 N8 O16 -","4","1","","Wu, Qiu-Zi; Mao, Yang-Jie; Zhou, Kun; Hao, Hong-Yan; Chen, Lei; Wang, Shuang; Xu, Zhen-Yuan; Lou, Shao-Jie; Xu, Dan-Qian","Regioselective C(sp<sup>3</sup>)-H fluorination of ketones: from methyl to the monofluoromethyl group.","Chemical communications (Cambridge, England)","2021","57","6","765","768","10.1039/d0cc07093a","","","0.71073","MoKα","","0.0798","0.053","","","0.1205","0.1419","","","","","","1.058","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127607","11.5001","0.0007","35.3868","0.0018","16.9363","0.001","90","","93.655","0.002","90","","6878.2","0.7","102","2","102","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C76 H107 Br Co N2 Ni -","- C76 H107 Br Co N2 Ni -","- C304 H428 Br4 Co4 N8 Ni4 -","4","1","","Zimmermann, Philipp; Kilpatrick, Alexander F. R.; Ar, Deniz; Demeshko, Serhiy; Cula, Beatrice; Limberg, Christian","Electron transfer within β-diketiminato nickel bromide and cobaltocene redox couples activating CO<sub>2</sub>.","Chemical communications (Cambridge, England)","2021","57","7","875","878","10.1039/d0cc06983c","","","0.71073","MoKα","","0.09","0.0633","","","0.1217","0.1337","","","","","","1.09","","","","has coordinates,has disorder","261560","2021-02-04","22:42:52",""
"7127608","22.236","0.002","9.3616","0.0008","16.9224","0.0018","90","","106.682","0.004","90","","3374.4","0.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H53 Br N2 Ni -","- C35 H53 Br N2 Ni -","- C140 H212 Br4 N8 Ni4 -","4","0.5","","Zimmermann, Philipp; Kilpatrick, Alexander F. R.; Ar, Deniz; Demeshko, Serhiy; Cula, Beatrice; Limberg, Christian","Electron transfer within β-diketiminato nickel bromide and cobaltocene redox couples activating CO<sub>2</sub>.","Chemical communications (Cambridge, England)","2021","57","7","875","878","10.1039/d0cc06983c","","","0.71073","MoKα","","0.0383","0.0309","","","0.0809","0.0849","","","","","","1.043","","","","has coordinates","261560","2021-02-04","22:42:52",""
"7127609","20.8867","0.0013","9.7066","0.0005","23.3746","0.0014","90","","109.046","0.002","90","","4479.5","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H63 Br Co N2 Ni -","- C45 H63 Br Co N2 Ni -","- C180 H252 Br4 Co4 N8 Ni4 -","4","1","","Zimmermann, Philipp; Kilpatrick, Alexander F. R.; Ar, Deniz; Demeshko, Serhiy; Cula, Beatrice; Limberg, Christian","Electron transfer within β-diketiminato nickel bromide and cobaltocene redox couples activating CO<sub>2</sub>.","Chemical communications (Cambridge, England)","2021","57","7","875","878","10.1039/d0cc06983c","","","0.71073","MoKα","","0.0875","0.0618","","","0.1197","0.1302","","","","","","1.099","","","","has coordinates","261560","2021-02-04","22:42:52",""
"7127610","16.501","0.0004","16.5277","0.0004","16.547","0.0003","84.401","0.002","66.537","0.002","69.279","0.002","3866.92","0.17","113","14","113","14","","","","","","","","3","P -1","-P 1","2","","","","- C88 H116 O8 -","- C88 H116 O8 -","- C176 H232 O16 -","2","1","","Dusold, Carolin; Weiss, Corinna; Hampel, Frank; Hirsch, Andreas","Synthesis and crystal packing of perylene-derivatives with extreme sterically demanding pentaphenylbenzene bay-substituents.","Chemical communications (Cambridge, England)","2021","57","5","583","586","10.1039/d0cc07773a","","x-ray","1.54184","CuKα","","0.2198","0.1977","","","0.5463","0.5795","","","","","","2.789","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127611","15.3455","0.0004","18.7629","0.0005","28.321","0.0005","105.764","0.002","95.876","0.002","95.998","0.002","7731.5","0.3","123","0.1","123","0.1","","","","","","","","3","P -1","-P 1","2","","","","- C176 H220 O8 -","- C176 H220 O8 -","- C352 H440 O16 -","2","1","","Dusold, Carolin; Weiss, Corinna; Hampel, Frank; Hirsch, Andreas","Synthesis and crystal packing of perylene-derivatives with extreme sterically demanding pentaphenylbenzene bay-substituents.","Chemical communications (Cambridge, England)","2021","57","5","583","586","10.1039/d0cc07773a","","x-ray","1.54184","CuKα","","0.1572","0.1307","","","0.3528","0.3996","","","","","","1.537","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127612","7.842","0.0003","12.562","0.0004","8.8611","0.0003","90","","109.444","0.004","90","","823.13","0.05","100","0.2","100","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 Cr P2 -","- C16 H24 Cr P2 -","- C32 H48 Cr2 P4 -","2","0.5","","Greer, Samuel M.; Üngor, Ökten; Beattie, Ross J.; Kiplinger, Jaqueline L.; Scott, Brian L.; Stein, Benjamin W.; Goodwin, Conrad A. P.","Low-spin 1,1'-diphosphametallocenates of chromium and iron.","Chemical communications (Cambridge, England)","2021","57","5","595","598","10.1039/d0cc06518h","","x-ray","0.71073","MoKα","","0.0268","0.0252","","","0.0655","0.0667","","","","","","1.091","","","","has coordinates","261536","2021-02-04","22:33:20",""
"7127613","14.2948","0.0007","12.8549","0.0006","8.8448","0.0004","90","","104.364","0.005","90","","1574.5","0.13","100","0.2","100","0.2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H24 Fe P2 -","- C16 H24 Fe P2 -","- C64 H96 Fe4 P8 -","4","0.5","","Greer, Samuel M.; Üngor, Ökten; Beattie, Ross J.; Kiplinger, Jaqueline L.; Scott, Brian L.; Stein, Benjamin W.; Goodwin, Conrad A. P.","Low-spin 1,1'-diphosphametallocenates of chromium and iron.","Chemical communications (Cambridge, England)","2021","57","5","595","598","10.1039/d0cc06518h","","x-ray","0.71073","MoKα","","0.0374","0.0312","","","0.0772","0.0798","","","","","","1.117","","","","has coordinates","261536","2021-02-04","22:33:20",""
"7127614","10.1947","0.0002","14.2373","0.0004","15.0677","0.0003","62.275","0.002","85.84","0.002","87.045","0.002","1930.42","0.08","100","0.2","100","0.2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H60 Fe K N2 O6 P2 -","- C34 H60 Fe K N2 O6 P2 -","- C68 H120 Fe2 K2 N4 O12 P4 -","2","1","","Greer, Samuel M.; Üngor, Ökten; Beattie, Ross J.; Kiplinger, Jaqueline L.; Scott, Brian L.; Stein, Benjamin W.; Goodwin, Conrad A. P.","Low-spin 1,1'-diphosphametallocenates of chromium and iron.","Chemical communications (Cambridge, England)","2021","57","5","595","598","10.1039/d0cc06518h","","x-ray","0.71073","MoKα","","0.054","0.04","","","0.0976","0.1035","","","","","","1.09","","","","has coordinates","261536","2021-02-04","22:33:20",""
"7127615","12.7189","0.0008","15.9437","0.001","17.8937","0.0012","64.066","0.006","85.655","0.005","86.321","0.005","3251.9","0.4","100","0.2","100","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H104 K2 N4 O13 P2 -","- C56 H104 K2 N4 O13 P2 -","- C112 H208 K4 N8 O26 P4 -","2","1","","Greer, Samuel M.; Üngor, Ökten; Beattie, Ross J.; Kiplinger, Jaqueline L.; Scott, Brian L.; Stein, Benjamin W.; Goodwin, Conrad A. P.","Low-spin 1,1'-diphosphametallocenates of chromium and iron.","Chemical communications (Cambridge, England)","2021","57","5","595","598","10.1039/d0cc06518h","","x-ray","0.71073","MoKα","","0.1063","0.0673","","","0.1648","0.1979","","","","","","1.063","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127616","8.0727","0.0002","8.74422","0.00019","18.4065","0.0004","103.174","0.0017","92.6248","0.0019","100.705","0.002","1237.81","0.05","150","0.01","150","0.01","","","","","","","","3","P -1","-P 1","2","","","","- C14 H17 P -","- C14 H17 P -","- C56 H68 P4 -","4","2","","Greer, Samuel M.; Üngor, Ökten; Beattie, Ross J.; Kiplinger, Jaqueline L.; Scott, Brian L.; Stein, Benjamin W.; Goodwin, Conrad A. P.","Low-spin 1,1'-diphosphametallocenates of chromium and iron.","Chemical communications (Cambridge, England)","2021","57","5","595","598","10.1039/d0cc06518h","","x-ray","1.54184","CuKα","","0.0344","0.0329","","","0.089","0.0899","","","","","","1.036","","","","has coordinates","261536","2021-02-04","22:33:20",""
"7127617","20.161","0.003","9.062","0.0004","20.214","0.003","90","","119.71","0.02","90","","3207.6","0.9","100","0.2","100","0.2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H48 Co2 P4 -","- C32 H48 Co2 P4 -","- C128 H192 Co8 P16 -","4","0.5","","Greer, Samuel M.; Üngor, Ökten; Beattie, Ross J.; Kiplinger, Jaqueline L.; Scott, Brian L.; Stein, Benjamin W.; Goodwin, Conrad A. P.","Low-spin 1,1'-diphosphametallocenates of chromium and iron.","Chemical communications (Cambridge, England)","2021","57","5","595","598","10.1039/d0cc06518h","","x-ray","0.71073","MoKα","","0.0491","0.0333","","","0.0775","0.0834","","","","","","1.009","","","","has coordinates","261536","2021-02-04","22:33:20",""
"7127618","10.1994","0.0004","14.2193","0.0007","15.0882","0.0006","62.328","0.004","86.597","0.003","87.156","0.003","1933.91","0.16","100","0.2","100","0.2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H60 Cr K N2 O6 P2 -","- C34 H60 Cr K N2 O6 P2 -","- C68 H120 Cr2 K2 N4 O12 P4 -","2","1","","Greer, Samuel M.; Üngor, Ökten; Beattie, Ross J.; Kiplinger, Jaqueline L.; Scott, Brian L.; Stein, Benjamin W.; Goodwin, Conrad A. P.","Low-spin 1,1'-diphosphametallocenates of chromium and iron.","Chemical communications (Cambridge, England)","2021","57","5","595","598","10.1039/d0cc06518h","","x-ray","0.71073","MoKα","","0.0459","0.0338","","","0.0816","0.0872","","","","","","1.1","","","","has coordinates","261536","2021-02-04","22:33:20",""
"7127619","14.1554","0.0008","9.6976","0.0004","12.0182","0.0006","90","","112.336","0.006","90","","1526","0.15","150","0.3","150","0.3","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","","- C18 H22 Zr -","- C18 H22 Zr -","- C72 H88 Zr4 -","4","0.5","","Greer, Samuel M.; Üngor, Ökten; Beattie, Ross J.; Kiplinger, Jaqueline L.; Scott, Brian L.; Stein, Benjamin W.; Goodwin, Conrad A. P.","Low-spin 1,1'-diphosphametallocenates of chromium and iron.","Chemical communications (Cambridge, England)","2021","57","5","595","598","10.1039/d0cc06518h","","x-ray","0.71073","MoKα","","0.0383","0.033","","","0.0771","0.0805","","","","","","1.068","","","","has coordinates,has disorder","261536","2021-02-04","22:33:20",""
"7127620","9.6777","0.0015","11.9462","0.0017","14.685","0.002","109.811","0.005","103.891","0.006","102.273","0.005","1468.1","0.4","150","","150","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C30 H36 Cl4 N2 Pt -","- C30 H36 Cl4 N2 Pt -","- C60 H72 Cl8 N4 Pt2 -","2","1","","Hagui, Wided; Cordier, Marie; Boixel, Julien; Soulé, Jean-François","Access to functionalized luminescent Pt(ii) complexes by photoredox-catalyzed Minisci alkylation of 6-aryl-2,2'-bipyridines.","Chemical communications (Cambridge, England)","2021","57","8","1038","1041","10.1039/d0cc07307e","","x-ray","0.71073","MoKα","","0.0335","0.0289","","","0.0744","0.0776","","","","","","1.047","","","","has coordinates","261528","2021-02-04","22:29:02",""
"7127621","8.856","0.0012","31.71","0.004","12.7673","0.0015","90","","95.735","0.005","90","","3567.4","0.8","150","","150","","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","","","","- C35 H47 Cl N2 O Pt -","- C35 H47 Cl N2 O Pt -","- C140 H188 Cl4 N8 O4 Pt4 -","4","2","","Hagui, Wided; Cordier, Marie; Boixel, Julien; Soulé, Jean-François","Access to functionalized luminescent Pt(ii) complexes by photoredox-catalyzed Minisci alkylation of 6-aryl-2,2'-bipyridines.","Chemical communications (Cambridge, England)","2021","57","8","1038","1041","10.1039/d0cc07307e","","x-ray","0.71073","MoKα","","0.0561","0.0478","","","0.1166","0.1222","","","","","","0.976","","","","has coordinates","261528","2021-02-04","22:29:02",""
"7127622","12.4262","0.0012","7.0266","0.0007","29.895","0.003","90","","93.655","0.004","90","","2604.9","0.4","150","","150","","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H37 Cl N2 Pt -","- C30 H37 Cl N2 Pt -","- C120 H148 Cl4 N8 Pt4 -","4","1","","Hagui, Wided; Cordier, Marie; Boixel, Julien; Soulé, Jean-François","Access to functionalized luminescent Pt(ii) complexes by photoredox-catalyzed Minisci alkylation of 6-aryl-2,2'-bipyridines.","Chemical communications (Cambridge, England)","2021","57","8","1038","1041","10.1039/d0cc07307e","","x-ray","0.71073","MoKα","","0.0428","0.0351","","","0.0803","0.0834","","","","","","1.099","","","","has coordinates,has disorder","261528","2021-02-04","22:29:02",""
"7127623","9.2662","0.0013","12.8513","0.0016","13.063","0.0017","89.934","0.005","86.739","0.005","81.967","0.005","1537.8","0.4","150","","150","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C34 H45 Cl N2 Pt -","- C34 H45 Cl N2 Pt -","- C68 H90 Cl2 N4 Pt2 -","2","1","","Hagui, Wided; Cordier, Marie; Boixel, Julien; Soulé, Jean-François","Access to functionalized luminescent Pt(ii) complexes by photoredox-catalyzed Minisci alkylation of 6-aryl-2,2'-bipyridines.","Chemical communications (Cambridge, England)","2021","57","8","1038","1041","10.1039/d0cc07307e","","x-ray","0.71073","MoKα","","0.0404","0.0322","","","0.0749","0.0795","","","","","","1.05","","","","has coordinates,has disorder","261528","2021-02-04","22:29:02",""
"7127624","9.7019","0.0007","19.1155","0.0015","14.6419","0.0011","90","","94.022","0.002","90","","2708.8","0.4","150","","150","","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H37 Cl N2 O2 Pt -","- C30 H37 Cl N2 O2 Pt -","- C120 H148 Cl4 N8 O8 Pt4 -","4","1","","Hagui, Wided; Cordier, Marie; Boixel, Julien; Soulé, Jean-François","Access to functionalized luminescent Pt(ii) complexes by photoredox-catalyzed Minisci alkylation of 6-aryl-2,2'-bipyridines.","Chemical communications (Cambridge, England)","2021","57","8","1038","1041","10.1039/d0cc07307e","","x-ray","0.71073","MoKα","","0.0405","0.0295","","","0.0682","0.075","","","","","","0.999","","","","has coordinates","261528","2021-02-04","22:29:02",""
"7127625","12.4019","0.0016","10.494","0.0014","25.54","0.003","90","","102.417","0.005","90","","3246.2","0.7","150","","150","","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H43 Cl3 N2 Pt -","- C35 H43 Cl3 N2 Pt -","- C140 H172 Cl12 N8 Pt4 -","4","1","","Hagui, Wided; Cordier, Marie; Boixel, Julien; Soulé, Jean-François","Access to functionalized luminescent Pt(ii) complexes by photoredox-catalyzed Minisci alkylation of 6-aryl-2,2'-bipyridines.","Chemical communications (Cambridge, England)","2021","57","8","1038","1041","10.1039/d0cc07307e","","x-ray","0.71073","MoKα","","0.0393","0.0302","","","0.074","0.0795","","","","","","0.934","","","","has coordinates,has disorder","261528","2021-02-04","22:29:02",""
"7127626","8.8293","0.0007","31.745","0.003","12.7745","0.0009","90","","95.744","0.003","90","","3562.5","0.5","150","","150","","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","","","","- C35 H47 Cl N2 O Pt -","- C35 H47 Cl N2 O Pt -","- C140 H188 Cl4 N8 O4 Pt4 -","4","2","","Hagui, Wided; Cordier, Marie; Boixel, Julien; Soulé, Jean-François","Access to functionalized luminescent Pt(ii) complexes by photoredox-catalyzed Minisci alkylation of 6-aryl-2,2'-bipyridines.","Chemical communications (Cambridge, England)","2021","57","8","1038","1041","10.1039/d0cc07307e","","x-ray","0.71073","MoKα","","0.088","0.0783","","","0.1933","0.1999","","","","","","1.071","","","","has coordinates","261528","2021-02-04","22:29:02",""
"7127627","11.599","0.0006","12.8851","0.0009","21.3522","0.0012","101.6","0.005","103.465","0.004","94.762","0.005","3011.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H42 Cd2 F8 N6 O8 -","- C66 H42 Cd2 F8 N6 O8 -","- C132 H84 Cd4 F16 N12 O16 -","2","1","","Wang, Yong; Wang, Meng-Fan; Young, David James; Zhu, Hua; Hu, Fei-Long; Mi, Yan; Qin, Zhen; Chen, Shu Li; Lang, Jian-Ping","Tuning the configuration of the flexible metal-alkene-framework affords pure cycloisomers in solid state photodimerization.","Chemical communications (Cambridge, England)","2021","57","9","1129","1132","10.1039/d0cc06939f","","","0.71073","MoKα","","0.1114","0.0554","","","0.1037","0.1361","","","","","","1.031","","","","has coordinates","261566","2021-02-04","22:45:59",""
"7127628","11.3948","0.0013","19.656","0.002","21.412","0.003","67.534","0.002","90.301","0.003","73.15","","4204.9","0.9","170","2","170","2","","","","","","","","6","P -1","-P 1","2","","","","- C88 H63 Cd3 Cl7 N6 O15 -","- C88 H63 Cd3 Cl7 N6 O15 -","- C176 H126 Cd6 Cl14 N12 O30 -","2","1","","Wang, Yong; Wang, Meng-Fan; Young, David James; Zhu, Hua; Hu, Fei-Long; Mi, Yan; Qin, Zhen; Chen, Shu Li; Lang, Jian-Ping","Tuning the configuration of the flexible metal-alkene-framework affords pure cycloisomers in solid state photodimerization.","Chemical communications (Cambridge, England)","2021","57","9","1129","1132","10.1039/d0cc06939f","","","0.71073","MoKα","","0.1326","0.0783","","","0.2072","0.2481","","","","","","1.047","","","","has coordinates","261566","2021-02-04","22:45:59",""
"7127629","12.2763","0.0011","12.7413","0.0012","13.7157","0.0013","76.21","0.008","67.384","0.009","63.288","0.009","1763.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H35 Cl3 N6 O2 -","- C39 H35 Cl3 N6 O2 -","- C78 H70 Cl6 N12 O4 -","2","1","","Wang, Yong; Wang, Meng-Fan; Young, David James; Zhu, Hua; Hu, Fei-Long; Mi, Yan; Qin, Zhen; Chen, Shu Li; Lang, Jian-Ping","Tuning the configuration of the flexible metal-alkene-framework affords pure cycloisomers in solid state photodimerization.","Chemical communications (Cambridge, England)","2021","57","9","1129","1132","10.1039/d0cc06939f","","","0.71073","MoKα","","0.1166","0.0788","","","0.1821","0.2138","","","","","","1.064","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127630","10.8951","0.0005","18.6016","0.0008","19.3051","0.0009","90","","90.318","0.006","90","","3912.4","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H36 N6 O3 -","- C38 H36 N6 O3 -","- C152 H144 N24 O12 -","4","1","","Wang, Yong; Wang, Meng-Fan; Young, David James; Zhu, Hua; Hu, Fei-Long; Mi, Yan; Qin, Zhen; Chen, Shu Li; Lang, Jian-Ping","Tuning the configuration of the flexible metal-alkene-framework affords pure cycloisomers in solid state photodimerization.","Chemical communications (Cambridge, England)","2021","57","9","1129","1132","10.1039/d0cc06939f","","","1.54184","CuKα","","0.0573","0.0378","","","0.1015","0.1032","","","","","","1.047","","","","has coordinates","261566","2021-02-04","22:45:59",""
"7127631","41.888","0.016","13.237","0.005","37.521","0.013","90","","102.236","0.013","90","","20332","13","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C99 H69 Cd3 N15 O24.75 -","- C99 H69 Cd3 N15 O24.75 -","- C792 H552 Cd24 N120 O198 -","8","1","","Wang, Yong; Wang, Meng-Fan; Young, David James; Zhu, Hua; Hu, Fei-Long; Mi, Yan; Qin, Zhen; Chen, Shu Li; Lang, Jian-Ping","Tuning the configuration of the flexible metal-alkene-framework affords pure cycloisomers in solid state photodimerization.","Chemical communications (Cambridge, England)","2021","57","9","1129","1132","10.1039/d0cc06939f","","","0.71073","MoKα","","0.0606","0.05","","","0.1338","0.144","","","","","","1.107","","","","has coordinates","261566","2021-02-04","22:45:59",""
"7127632","11.2823","0.0007","19.727","0.0013","21.7507","0.0015","67.553","0.001","90.202","0.001","73.38","","4252.4","0.5","170","2","170","2","","","","","","","","6","P -1","-P 1","2","","","","- C87 H59 Br7 Cd3 N6 O16 -","- C87 H59 Br7 Cd3 N6 O16 -","- C174 H118 Br14 Cd6 N12 O32 -","2","1","","Wang, Yong; Wang, Meng-Fan; Young, David James; Zhu, Hua; Hu, Fei-Long; Mi, Yan; Qin, Zhen; Chen, Shu Li; Lang, Jian-Ping","Tuning the configuration of the flexible metal-alkene-framework affords pure cycloisomers in solid state photodimerization.","Chemical communications (Cambridge, England)","2021","57","9","1129","1132","10.1039/d0cc06939f","","","0.71073","MoKα","","0.0933","0.0674","","","0.1949","0.216","","","","","","1.043","","","","has coordinates,has disorder","261566","2021-02-04","22:45:59",""
"7127633","11.308","0.005","20.365","0.008","20.908","0.009","110.484","0.005","100.264","0.006","96.098","0.006","4363","3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C90 H78 Cd3 N6 O14 -","- C90 H78 Cd3 N6 O14 -","- C180 H156 Cd6 N12 O28 -","2","1","","Wang, Yong; Wang, Meng-Fan; Young, David James; Zhu, Hua; Hu, Fei-Long; Mi, Yan; Qin, Zhen; Chen, Shu Li; Lang, Jian-Ping","Tuning the configuration of the flexible metal-alkene-framework affords pure cycloisomers in solid state photodimerization.","Chemical communications (Cambridge, England)","2021","57","9","1129","1132","10.1039/d0cc06939f","","","0.71073","MoKα","","0.0638","0.0432","","","0.1182","0.1321","","","","","","1.014","","","","has coordinates","261566","2021-02-04","22:45:59",""
"7127634","17.836","0.004","18.86","0.003","19.709","0.004","90","","90","","90","","6630","2","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C32 H42 Cl2 N2 Ru2 Zn -","- C32 H42 Cl2 N2 Ru2 Zn -","- C256 H336 Cl16 N16 Ru16 Zn8 -","8","1","","Takemoto, Shin; Yoshii, Kaname; Yamano, Takahiro; Tsurusaki, Akihiro; Matsuzaka, Hiroyuki","Metal-metal multiple bond formation induced by σ-acceptor Lewis acid ligands.","Chemical communications (Cambridge, England)","2021","57","7","923","926","10.1039/d0cc07278h","","","0.71075","MoKα","","0.0359","0.0256","","","0.0619","0.0666","","","","","","1.016","","","","has coordinates","261556","2021-02-04","22:41:42",""
"7127635","10.4804","0.0007","10.774","0.0008","19.5872","0.0014","90.737","0.006","94.454","0.007","104.508","0.007","2133.5","0.3","173","","173","","","","","","","","","9","P -1","-P 1","2","","","","- C35 H44 Cl2 F6 N2 O6 Ru2 S2 Sn -","- C35 H44 Cl2 F6 N2 O6 Ru2 S2 Sn -","- C70 H88 Cl4 F12 N4 O12 Ru4 S4 Sn2 -","2","1","","Takemoto, Shin; Yoshii, Kaname; Yamano, Takahiro; Tsurusaki, Akihiro; Matsuzaka, Hiroyuki","Metal-metal multiple bond formation induced by σ-acceptor Lewis acid ligands.","Chemical communications (Cambridge, England)","2021","57","7","923","926","10.1039/d0cc07278h","","","0.71075","MoKα","","0.0731","0.0604","","","0.167","0.1718","","","","","","1.315","","","","has coordinates","261556","2021-02-04","22:41:42",""
"7127636","21.678","0.0005","15.5432","0.0004","21.2981","0.0005","90","","94.863","0.007","90","","7150.5","0.3","173","","173","","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C33 H42 Cl F3 N2 O3 Ru2 S Sn -","- C33 H42 Cl F3 N2 O3 Ru2 S Sn -","- C264 H336 Cl8 F24 N16 O24 Ru16 S8 Sn8 -","8","2","","Takemoto, Shin; Yoshii, Kaname; Yamano, Takahiro; Tsurusaki, Akihiro; Matsuzaka, Hiroyuki","Metal-metal multiple bond formation induced by σ-acceptor Lewis acid ligands.","Chemical communications (Cambridge, England)","2021","57","7","923","926","10.1039/d0cc07278h","","","0.71075","MoKα","","0.0679","0.048","","","0.1046","0.1149","","","","","","1.03","","","","has coordinates","261556","2021-02-04","22:41:42",""
"7127637","17.575","0.0006","18.588","0.0006","20.2407","0.0008","90","","90","","90","","6612.3","0.4","296","","296","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C32 H42 Cl2 N2 Pb Ru2 -","- C32 H42 Cl2 N2 Pb Ru2 -","- C256 H336 Cl16 N16 Pb8 Ru16 -","8","1","","Takemoto, Shin; Yoshii, Kaname; Yamano, Takahiro; Tsurusaki, Akihiro; Matsuzaka, Hiroyuki","Metal-metal multiple bond formation induced by σ-acceptor Lewis acid ligands.","Chemical communications (Cambridge, England)","2021","57","7","923","926","10.1039/d0cc07278h","","","0.71075","MoKα","","0.0999","0.044","","","0.0637","0.0741","","","","","","1","","","","has coordinates","261556","2021-02-04","22:41:42",""
"7127638","12.8805","0.0005","11.6857","0.0004","9.66","0.0004","90","","115.998","0.001","90","","1306.87","0.09","296","2","273.15","","","","","","","","","4","C 1 m 1","C -2y","8","","","","- Ag3 Ga8 K Se14 -","- Ag3 Ga8 K Se14 -","- Ag6 Ga16 K2 Se28 -","2","0.5","","Li, Jia-Nuo; Yao, Wen-Dong; Li, Xiao-Hui; Liu, Wenlong; Xue, Huai-Guo; Guo, Sheng-Ping","A novel promising infrared nonlinear optical selenide KAg<sub>3</sub>Ga<sub>8</sub>Se<sub>14</sub> designed from benchmark AgGaQ<sub>2</sub> (Q = S, Se).","Chemical communications (Cambridge, England)","2021","57","9","1109","1112","10.1039/d0cc07396b","","","0.71073","MoKα","","0.0282","0.025","","","0.0512","0.0526","","","","","","0.919","","","","has coordinates","261565","2021-02-04","22:45:09",""
"7127639","24.4515","0.001","24.4515","0.001","37.034","0.003","90","","90","","90","","22142","2","293","2","293","2","","","","","","","","5","P 42/m c m","-P 4c 2c","132","","","","- C210 H352 Mo12 N16 O82 -","- C76 H36 Mo12 N2 O78 -","- C304 H144 Mo48 N8 O312 -","4","0.25","","Wang, Xin-Ying; Chen, Wei-Chao; Shao, Kui-Zhan; Wang, Xin-Long; Zhao, Liang; Su, Zhong-Min","An octahedral polyoxomolybdate-organic molecular cage.","Chemical communications (Cambridge, England)","2021","57","8","1042","1045","10.1039/d0cc07120j","","","0.71073","MoKα","","0.0781","0.0595","","","0.1761","0.2052","","","","","","1.015","","","","has coordinates","261531","2021-02-04","22:30:23",""
"7127640","24.1759","0.0006","24.1759","0.0006","36.5135","0.0018","90","","90","","90","","21341.2","1.3","173","2","173","2","","","","","","","","6","P 42/m c m","-P 4c 2c","132","","","","- C72 H56 Cl10 Cs22 Mo12 O94 -","- C72 H24 Cl3 Cs8.75 Mo12 O87.5 -","- C288 H96 Cl12 Cs35 Mo48 O350 -","4","0.25","","Wang, Xin-Ying; Chen, Wei-Chao; Shao, Kui-Zhan; Wang, Xin-Long; Zhao, Liang; Su, Zhong-Min","An octahedral polyoxomolybdate-organic molecular cage.","Chemical communications (Cambridge, England)","2021","57","8","1042","1045","10.1039/d0cc07120j","","","0.71073","MoKα","","0.091","0.0777","","","0.2308","0.2541","","","","","","1.036","","","","has coordinates,has disorder","261531","2021-02-04","22:30:23",""
"7127641","11.1397","0.0005","15.3727","0.0009","15.8265","0.001","63.174","0.006","76.983","0.005","82.077","0.004","2354.4","0.3","100","2","100","2","","","","","","","synthesis","6","P -1","-P 1","2","","","","- C48 H57 Cl Cu N4 O6 -","- C48 H57 Cl Cu N4 O6 -","- C96 H114 Cl2 Cu2 N8 O12 -","2","1","","Sarkar, Prasenjit; Sarmah, Amrit; Mukherjee, Chandan","Synthesis, crystallographic and spectroscopic characterization, and theoretical elucidation of an elusive aminyl radical containing a Cu<sup>II</sup>-aminyl-iminosemiquinone complex.","Chemical communications (Cambridge, England)","2021","57","11","1352","1355","10.1039/d0cc07378d","","x-ray","0.71073","MoKα","","0.064","0.0549","","","0.1447","0.1512","","","","","","1.048","","","","has coordinates","262517","2021-03-05","01:24:53",""
"7127642","16.406","0.003","25.363","0.006","23.926","0.012","90","","90","","90","","9956","6","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- I14 K4 O51 U2 -","- I14 K4 O51 U2 -","- I112 K32 O408 U16 -","8","2","","Murphy, Gabriel L.; Wang, Yaxing; Kegler, Philip; Wang, Yumin; Wang, Shuao; Alekseev, Evgeny V.","The first actinide polyiodate: a complex multifunctional compound with promising X-ray luminescence properties and proton conductivity.","Chemical communications (Cambridge, England)","2021","57","4","496","499","10.1039/d0cc06835g","","","0.71073","MoKα","","0.0808","0.0547","","","0.1166","0.1317","","","","","","1.059","","","","has coordinates","261539","2021-02-04","22:33:59",""
"7127643","4.901","0.0005","9.8031","0.0013","15.0217","0.0015","98.809","0.01","90.521","0.008","95.037","0.009","710.26","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H17 Cu N O5 S -","- C13 H17 Cu N O5 S -","- C26 H34 Cu2 N2 O10 S2 -","2","1","","Li, Jun-Yi; Xu, Qiu-Ling; Ye, Si-Yu; Tong, Liang; Chen, Xiang; Chen, Li-Zhuang","A multiaxial molecular ferroelectric with record high <i>T</i><sub>C</sub> designed by intermolecular interaction modulation.","Chemical communications (Cambridge, England)","2021","57","7","943","946","10.1039/d0cc07377f","","","1.54184","CuKα","","0.0702","0.0626","","","0.1574","0.16","","","","","","1.242","","","","has coordinates","298703","2025-04-03","05:34:20",""
"7127644","14.4585","0.0003","13.1776","0.0003","14.7761","0.0003","90","","90","","90","","2815.27","0.1","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H17 I3 N2 Zn -","- C8 H17 I3 N2 Zn -","- C64 H136 I24 N16 Zn8 -","8","1","","Li, Jun-Yi; Xu, Qiu-Ling; Ye, Si-Yu; Tong, Liang; Chen, Xiang; Chen, Li-Zhuang","A multiaxial molecular ferroelectric with record high <i>T</i><sub>C</sub> designed by intermolecular interaction modulation.","Chemical communications (Cambridge, England)","2021","57","7","943","946","10.1039/d0cc07377f","","","0.71073","MoKα","","0.0632","0.0577","","","0.1838","0.1896","","","","","","1.074","","","","has coordinates","261558","2021-02-04","22:42:23",""
"7127645","9.502","0.0003","12.1104","0.0004","12.4906","0.0004","90","","94.573","0.002","90","","1432.76","0.08","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C7 H14 F I3 N2 Zn -","- C7 H14 F I3 N2 Zn -","- C28 H56 F4 I12 N8 Zn4 -","4","1","","Li, Jun-Yi; Xu, Qiu-Ling; Ye, Si-Yu; Tong, Liang; Chen, Xiang; Chen, Li-Zhuang","A multiaxial molecular ferroelectric with record high <i>T</i><sub>C</sub> designed by intermolecular interaction modulation.","Chemical communications (Cambridge, England)","2021","57","7","943","946","10.1039/d0cc07377f","","","0.71073","MoKα","","0.0426","0.0345","","","0.0876","0.0914","","","","","","1.122","","","","has coordinates","261558","2021-02-04","22:42:23",""
"7127646","19.9308","0.0014","7.8474","0.0005","9.8836","0.0007","90","","90","","90","","1545.84","0.18","296","2","296","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C8 H16 F I3 N2 Zn -","- C8 H16 F I3 N2 Zn -","- C32 H64 F4 I12 N8 Zn4 -","4","1","","Li, Jun-Yi; Xu, Qiu-Ling; Ye, Si-Yu; Tong, Liang; Chen, Xiang; Chen, Li-Zhuang","A multiaxial molecular ferroelectric with record high <i>T</i><sub>C</sub> designed by intermolecular interaction modulation.","Chemical communications (Cambridge, England)","2021","57","7","943","946","10.1039/d0cc07377f","","","0.71073","MoKα","","0.028","0.0274","","","0.0708","0.0712","","","","","","1.108","","","","has coordinates","261558","2021-02-04","22:42:27",""
"7127654","10.292","0.0002","13.7654","0.0002","9.3825","0.0002","90","","108.771","0.002","90","","1258.55","0.04","125.01","0.1","125.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 N2 O2 S -","- C13 H18 N2 O2 S -","- C52 H72 N8 O8 S4 -","4","1","","Griggs, Samuel D.; Martin-Roncero, Alejandro; Nelson, Adam; Marsden, Stephen P.","Regioselective side-chain amination of 2-alkyl azacycles by radical translocation: total synthesis of tetraponerine T8.","Chemical communications (Cambridge, England)","2021","57","7","919","922","10.1039/d0cc07625b","","x-ray","1.54184","CuKα","","0.0374","0.0328","","","0.0804","0.0842","","","","","","1.045","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127655","8.427","0.001","13.1722","0.0012","9.2077","0.001","90","","104.737","0.011","90","","988.45","0.19","125.01","0.1","125.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H17 N2 O2 S -","- C8 H17 N2 O2 S -","- C32 H68 N8 O8 S4 -","4","1","","Griggs, Samuel D.; Martin-Roncero, Alejandro; Nelson, Adam; Marsden, Stephen P.","Regioselective side-chain amination of 2-alkyl azacycles by radical translocation: total synthesis of tetraponerine T8.","Chemical communications (Cambridge, England)","2021","57","7","919","922","10.1039/d0cc07625b","","x-ray","1.54184","CuKα","","0.0947","0.0741","","","0.2024","0.2113","","","","","","1.106","","","","has coordinates,has disorder","261557","2021-02-04","22:41:53",""
"7127656","9.3294","0.0005","20.3329","0.0014","12.2453","0.0009","90","","97.005","0.007","90","","2305.5","0.3","120","0.1","120","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H17 N2 O3 S -","- C9 H17 N2 O3 S -","- C72 H136 N16 O24 S8 -","8","2","","Griggs, Samuel D.; Martin-Roncero, Alejandro; Nelson, Adam; Marsden, Stephen P.","Regioselective side-chain amination of 2-alkyl azacycles by radical translocation: total synthesis of tetraponerine T8.","Chemical communications (Cambridge, England)","2021","57","7","919","922","10.1039/d0cc07625b","","x-ray","1.54184","CuKα","","0.1114","0.0818","","","0.1841","0.2002","","","","","","1.083","","","","has coordinates","261557","2021-02-04","22:41:53",""
"7127657","9.5439","0.0002","10.6657","0.0002","14.8023","0.0003","86.851","0.002","73.687","0.002","74.975","0.002","1396.4","0.05","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C27.5 H17.5 B Cl7.5 N O2 -","- C27.5 H17.501 B Cl7.503 N O2 -","- C55 H35.002 B2 Cl15.006 N2 O4 -","2","1","","Nakazato, Takumi; Shinokubo, Hiroshi; Miyake, Yoshihiro","Complexation of 2,7-diazapyrene with boron for structural and electronic tuning.","Chemical communications (Cambridge, England)","2021","57","3","327","330","10.1039/d0cc07804b","","","0.71073","MoKα","","0.0634","0.0551","","","0.1521","0.1579","","","","","","1.097","","","","has coordinates,has disorder","261575","2021-02-04","22:49:07",""
"7127658","17.3635","0.0005","15.4653","0.0005","16.2291","0.0006","90","","90","","90","","4358","0.2","93","2","93","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C60.5 H42 B2 N2 O4 -","- C60.5 H42 B2 N2 O4 -","- C242 H168 B8 N8 O16 -","4","1","","Nakazato, Takumi; Shinokubo, Hiroshi; Miyake, Yoshihiro","Complexation of 2,7-diazapyrene with boron for structural and electronic tuning.","Chemical communications (Cambridge, England)","2021","57","3","327","330","10.1039/d0cc07804b","","","0.71073","MoKα","","0.1026","0.0766","","","0.1712","0.1836","","","","","","1.085","","","","has coordinates,has disorder","261575","2021-02-04","22:49:07",""
"7127659","10.2198","0.0006","24.316","0.0012","11.2287","0.0006","90","","104.852","0.006","90","","2697.2","0.3","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H34 F6 N2 O6 S2 -","- C20 H34 F6 N2 O6 S2 -","- C80 H136 F24 N8 O24 S8 -","4","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.063","0.0547","","","0.1388","0.1447","","","","","","1.055","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127660","13.286","0.003","16.169","0.003","20.044","0.004","90","","91.44","0.03","90","","4304.5","1.5","170","2","170.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H32 F6 N2 Sb -","- C18 H32 F6 N2 Sb -","- C144 H256 F48 N16 Sb8 -","8","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.1493","0.0555","","","0.1021","0.1356","","","","","","0.956","","","","has coordinates,has disorder","262470","2021-03-05","01:15:36",""
"7127661","16.0963","0.0007","12.0415","0.0005","14.8878","0.0006","90","","92.041","0.004","90","","2883.8","0.2","173","0.1","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 F6 N2 O6 S2 -","- C24 H36 F6 N2 O6 S2 -","- C96 H144 F24 N8 O24 S8 -","4","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.114","0.0954","","","0.2351","0.2437","","","","","","1.091","","","","has coordinates,has disorder","262470","2021-03-05","01:15:36",""
"7127662","10.0062","0.0006","12.0297","0.0005","23.0723","0.0011","90","","90","","90","","2777.2","0.2","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H36 F6 N2 O6 S2 -","- C21 H36 F6 N2 O6 S2 -","- C84 H144 F24 N8 O24 S8 -","4","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.05","0.0427","","","0.1019","0.1052","","","","","","1.034","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127663","9.3676","0.0006","20.7476","0.001","11.0903","0.0007","90","","109.3","0.007","90","","2034.3","0.2","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H38 N2 -","- C22 H38 N2 -","- C88 H152 N8 -","4","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.0833","0.0583","","","0.1533","0.1649","","","","","","1.06","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127664","8.6542","0.0003","11.7196","0.0005","35.017","0.0014","90","","90","","90","","3551.6","0.2","120","0.1","120","0.1","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H34 N2 -","- C19 H34 N2 -","- C152 H272 N16 -","8","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.0688","0.0511","","","0.1184","0.1258","","","","","","1.056","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127665","10.4927","0.0003","11.3753","0.0004","12.8459","0.0004","67.712","0.003","72.257","0.003","66.569","0.003","1280.14","0.08","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H30 F6 N2 O6 S2 -","- C20 H30 F6 N2 O6 S2 -","- C40 H60 F12 N4 O12 S4 -","2","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.0646","0.0502","","","0.1243","0.1317","","","","","","1.11","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127666","15.7269","0.0005","16.633","0.0003","16.7087","0.0004","90","","90.073","0.002","90","","4370.75","0.19","119.98","0.1","119.98","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H34 F3 N2 O3 S -","- C20 H34 F3 N2 O3 S -","- C160 H272 F24 N16 O24 S8 -","8","2","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.0482","0.0378","","","0.0894","0.0929","","","","","","1.059","","","","has coordinates","262470","2021-03-05","01:15:36",""
"7127667","15.5683","0.0014","15.5783","0.0014","10.02","0.002","90","","90","","90","","2430.1","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H38 F6 N2 Sb -","- C22 H38 F6 N2 Sb -","- C88 H152 F24 N8 Sb4 -","4","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.0606","0.0396","","","0.098","0.1079","","","","","","0.984","","","","has coordinates,has disorder","262470","2021-03-05","01:15:36",""
"7127668","11.3706","0.0009","8.1457","0.0004","18.6134","0.0011","90","","91.043","0.007","90","","1723.72","0.19","240","2","240","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H32 N2 -","- C18 H32 N2 -","- C72 H128 N8 -","4","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.0859","0.075","","","0.2041","0.2127","","","","","","1.045","","","","has coordinates,has disorder","301860","2025-08-22","09:26:53",""
"7127669","11.2936","0.0004","16.1144","0.0004","16.1904","0.0005","90","","91.094","0.003","90","","2945.95","0.16","120","0.1","120","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H40 F6 N2 O6 S2 -","- C24 H40 F6 N2 O6 S2 -","- C96 H160 F24 N8 O24 S8 -","4","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.0486","0.0411","","","0.105","0.1091","","","","","","1.054","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127670","8.9365","0.0002","16.2526","0.0003","18.4341","0.0003","90","","90","","90","","2677.39","0.09","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H34 F6 N2 O6 S2 -","- C21 H34 F6 N2 O6 S2 -","- C84 H136 F24 N8 O24 S8 -","4","1","","Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul","Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications.","Chemical communications (Cambridge, England)","2021","57","10","1210","1213","10.1039/d0cc07385g","","","0.71073","MoKα","","0.0455","0.0424","","","0.097","0.0984","","","","","","1.124","","","","has coordinates,has disorder","262470","2021-03-05","01:15:36",""
"7127671","22.6175","0.0015","14.6158","0.0008","11.7728","0.0007","90","","100.296","0.002","90","","3829.1","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H21 N O -","- C24 H21 N O -","- C192 H168 N8 O8 -","8","1","","Dai, Ling; Yu, Shuling; Shao, Yinlin; Li, Renhao; Chen, Zhongyan; Lv, Ningning; Chen, Jiuxi","Palladium-catalyzed C-H activation of simple arenes and cascade reaction with nitriles: access to 2,4,5-trisubstituted oxazoles.","Chemical communications (Cambridge, England)","2021","57","11","1376","1379","10.1039/d0cc07547g","","","0.71073","MoKα","","0.0762","0.0475","","","0.1132","0.1335","","","","","","1.022","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127672","9.1878","0.0013","17.217","0.002","15.06","0.002","90","","99.657","0.002","90","","2348.5","0.5","296","2","296.15","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32 H22 O3 -","- C32 H22 O3 -","- C128 H88 O12 -","4","1","","Wu, Jiaoyu; Bai, Lu; Han, Lingbo; Liu, Jingjing; Luan, Xinjun","A chemo- and regioselective Pd(0)-catalyzed three-component spiroannulation.","Chemical communications (Cambridge, England)","2021","57","9","1117","1120","10.1039/d0cc07389j","","","0.71073","MoKα","","0.0738","0.0471","","","0.1069","0.1203","","","","","","0.925","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127673","12.2505","0.0017","13.305","0.004","14.427","0.002","90","","97.071","0.009","90","","2333.6","0.8","140","2","140","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32 H22 O3 -","- C32 H22 O3 -","- C128 H88 O12 -","4","1","","Wu, Jiaoyu; Bai, Lu; Han, Lingbo; Liu, Jingjing; Luan, Xinjun","A chemo- and regioselective Pd(0)-catalyzed three-component spiroannulation.","Chemical communications (Cambridge, England)","2021","57","9","1117","1120","10.1039/d0cc07389j","","","1.34138","GaKα","","0.0398","0.0386","","","0.0942","0.095","","","","","","1.043","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127674","14.047","0.005","11.407","0.004","16.479","0.005","90","","110.628","0.006","90","","2471.2","1.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H30 O Si -","- C30 H30 O Si -","- C120 H120 O4 Si4 -","4","1","","Wu, Jiaoyu; Bai, Lu; Han, Lingbo; Liu, Jingjing; Luan, Xinjun","A chemo- and regioselective Pd(0)-catalyzed three-component spiroannulation.","Chemical communications (Cambridge, England)","2021","57","9","1117","1120","10.1039/d0cc07389j","","","0.71073","MoKα","","0.108","0.0637","","","0.1726","0.1996","","","","","","1.03","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127675","23.0769","0.001","6.4038","0.0002","24.0305","0.001","90","","97.876","0.002","90","","3517.7","0.2","170","","170","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C23 H20 F N -","- C23 H20 F N -","- C184 H160 F8 N8 -","8","1","","Fu, Zhiyuan; Zhu, Jianping; Guo, Songjin; Lin, Aijun","Palladium-catalyzed allylic alkylation dearomatization of β-naphthols and indoles with <i>gem</i>-difluorinated cyclopropanes.","Chemical communications (Cambridge, England)","2021","57","10","1262","1265","10.1039/d0cc07529a","","","0.71073","MoKα","","0.0915","0.0503","","","0.1025","0.1235","","","","","","1.035","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127676","9.3789","0.0004","9.718","0.0003","22.5084","0.0009","90","","100.325","0.002","90","","2018.29","0.13","170","","170","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H23 F O -","- C27 H23 F O -","- C108 H92 F4 O4 -","4","1","","Fu, Zhiyuan; Zhu, Jianping; Guo, Songjin; Lin, Aijun","Palladium-catalyzed allylic alkylation dearomatization of β-naphthols and indoles with <i>gem</i>-difluorinated cyclopropanes.","Chemical communications (Cambridge, England)","2021","57","10","1262","1265","10.1039/d0cc07529a","","","0.71073","MoKα","","0.1022","0.0519","","","0.1135","0.1435","","","","","","1.02","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127677","9.3957","0.001","13.3926","0.0015","11.5446","0.0013","90","","100.979","0.002","90","","1426.1","0.3","296","2","296.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H15 N O3 S -","- C16 H15 N O3 S -","- C64 H60 N4 O12 S4 -","4","1","","Hu, Xiao-Qiang; Liu, Zi-Kui; Hou, Ye-Xing; Zhang, Guodong; Gao, Yang","Ru-catalysed C(sp<sup>2</sup>)-H vinylation/annulation of benzoic acids and alkynes: rapid access to medium-sized lactones.","Chemical communications (Cambridge, England)","2021","57","9","1113","1116","10.1039/d0cc07573f","","","0.71073","MoKα","","0.0721","0.0583","","","0.1631","0.1797","","","","","","1.028","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127678","12.9266","0.0007","11.3139","0.0003","25.9903","0.0012","90","","92.369","0.004","90","","3797.8","0.3","85","2","85","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H49 F N7 Ni O2 -","- C44 H49 F N7 Ni O2 -","- C176 H196 F4 N28 Ni4 O8 -","4","1","","Wilson, Jessica R.; Zeller, Matthias; Szymczak, Nathaniel K.","Hydrogen-bonded nickel(I) complexes.","Chemical communications (Cambridge, England)","2021","57","6","753","756","10.1039/d0cc07216h","","","1.54178","CuKα","","0.1159","0.0634","","","0.1521","0.1837","","","","","","0.987","","","","has coordinates,has disorder","261553","2021-02-04","22:39:51",""
"7127679","9.3841","0.0004","24.5577","0.0013","14.254","0.0007","90","","98.5049","0.0017","90","","3248.7","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H33 Cl2 N7 Ni -","- C36 H33 Cl2 N7 Ni -","- C144 H132 Cl8 N28 Ni4 -","4","1","","Wilson, Jessica R.; Zeller, Matthias; Szymczak, Nathaniel K.","Hydrogen-bonded nickel(I) complexes.","Chemical communications (Cambridge, England)","2021","57","6","753","756","10.1039/d0cc07216h","","","0.71073","MoKα","","0.0464","0.0326","","","0.0773","0.0839","","","","","","1.031","","","","has coordinates","261553","2021-02-04","22:39:51",""
"7127680","14.3923","0.0006","16.9751","0.0006","29.3848","0.0013","90","","90","","90","","7179","0.5","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C38 H36 F7 N8 Ni P -","- C38 H36 F7 N8 Ni P -","- C304 H288 F56 N64 Ni8 P8 -","8","1","","Wilson, Jessica R.; Zeller, Matthias; Szymczak, Nathaniel K.","Hydrogen-bonded nickel(I) complexes.","Chemical communications (Cambridge, England)","2021","57","6","753","756","10.1039/d0cc07216h","","","0.71073","MoKα","","0.0658","0.0384","","","0.0863","0.0982","","","","","","1.021","","","","has coordinates","261553","2021-02-04","22:39:51",""
"7127681","11.1857","0.0004","14.8673","0.0005","14.6645","0.0005","90","","109.281","0.0012","90","","2301.94","0.14","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H42 Cl2 F12 N10 Ni2 P2 -","- C40 H42 Cl2 F12 N10 Ni2 P2 -","- C80 H84 Cl4 F24 N20 Ni4 P4 -","2","0.5","","Wilson, Jessica R.; Zeller, Matthias; Szymczak, Nathaniel K.","Hydrogen-bonded nickel(I) complexes.","Chemical communications (Cambridge, England)","2021","57","6","753","756","10.1039/d0cc07216h","","","0.71073","MoKα","","0.0375","0.0289","","","0.07","0.0743","","","","","","1.038","","","","has coordinates,has disorder","261553","2021-02-04","22:39:51",""
"7127682","8.7389","0.0005","15.7231","0.0008","30.6187","0.0014","90","","90.9491","0.0016","90","","4206.5","0.4","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H21 Cl2 N5 Ni -","- C20 H21 Cl2 N5 Ni -","- C160 H168 Cl16 N40 Ni8 -","8","4","","Wilson, Jessica R.; Zeller, Matthias; Szymczak, Nathaniel K.","Hydrogen-bonded nickel(I) complexes.","Chemical communications (Cambridge, England)","2021","57","6","753","756","10.1039/d0cc07216h","","","0.71073","MoKα","","0.0336","0.0278","","","0.06","0.0628","","","","","","1.05","","","","has coordinates","261553","2021-02-04","22:39:51",""
"7127683","13.6496","0.0007","25.0037","0.0014","11.8291","0.0006","90","","111.587","0.0019","90","","3754","0.3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38 H36 Br F6 N8 Ni P -","- C38 H36 Br F6 N8 Ni P -","- C152 H144 Br4 F24 N32 Ni4 P4 -","4","1","","Wilson, Jessica R.; Zeller, Matthias; Szymczak, Nathaniel K.","Hydrogen-bonded nickel(I) complexes.","Chemical communications (Cambridge, England)","2021","57","6","753","756","10.1039/d0cc07216h","","","0.71073","MoKα","","0.0435","0.0351","","","0.1006","0.1053","","","","","","1.041","","","","has coordinates","261553","2021-02-04","22:39:51",""
"7127684","13.6446","0.0007","24.7833","0.0011","11.7844","0.0006","90","","111.372","0.0017","90","","3711","0.3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38 H36 Cl F6 N8 Ni P -","- C38 H36 Cl F6 N8 Ni P -","- C152 H144 Cl4 F24 N32 Ni4 P4 -","4","1","","Wilson, Jessica R.; Zeller, Matthias; Szymczak, Nathaniel K.","Hydrogen-bonded nickel(I) complexes.","Chemical communications (Cambridge, England)","2021","57","6","753","756","10.1039/d0cc07216h","","","0.71073","MoKα","","0.0443","0.032","","","0.0784","0.0853","","","","","","1.031","","","","has coordinates","261553","2021-02-04","22:39:51",""
"7127685","8.3715","0.0006","33.178","0.003","7.1858","0.0004","90","","90","","90","","1995.9","0.3","150","2","150","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C20 H26 N4 O3 -","- C20 H26 N4 O3 -","- C80 H104 N16 O12 -","4","1","","Gambhir, Diksha; Mondal, Bhaskar; Koner, Rik Rani","Molecular-level insights into the self-assembly driven enantioselective recognition process.","Chemical communications (Cambridge, England)","2021","57","20","2535","2538","10.1039/d0cc06612e","","","1.54184","CuKα","","0.1351","0.1243","","","0.3434","0.3646","","","","","","1.52","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127686","10.8104","0.0005","5.7783","0.0003","21.3807","0.001","90","","91.903","0.005","90","","1334.82","0.11","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H32 N4 O5 -","- C28 H32 N4 O5 -","- C56 H64 N8 O10 -","2","1","","Gambhir, Diksha; Mondal, Bhaskar; Koner, Rik Rani","Molecular-level insights into the self-assembly driven enantioselective recognition process.","Chemical communications (Cambridge, England)","2021","57","20","2535","2538","10.1039/d0cc06612e","","x-ray","1.54184","CuKα","","0.0384","0.0343","","","0.0796","0.0815","","","","","","0.988","","","","has coordinates","263643","2021-04-05","14:01:16",""
"7127687","10.8308","0.0008","5.779","0.0004","21.3692","0.0013","90","","91.933","0.007","90","","1336.76","0.16","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H32 N4 O5 -","- C28 H32 N4 O5 -","- C56 H64 N8 O10 -","2","1","","Gambhir, Diksha; Mondal, Bhaskar; Koner, Rik Rani","Molecular-level insights into the self-assembly driven enantioselective recognition process.","Chemical communications (Cambridge, England)","2021","57","20","2535","2538","10.1039/d0cc06612e","","x-ray","1.54184","CuKα","","0.0462","0.0389","","","0.0887","0.0921","","","","","","0.99","","","","has coordinates","263643","2021-04-05","14:01:16",""
"7127691","10.3145","0.0002","10.3145","0.0002","10.3145","0.0002","90","","90","","90","","1097.35","0.04","293","2","293","2","","","","","","","","3","I -4 3 m","I -4 2 3","217","","","","- As14 Ba Ge8 -","- As14 Ba Ge8 -","- As28 Ba2 Ge16 -","2","0.0416667","","Weippert, Valentin; Chau, Thanh; Witthaut, Kristian; Eisenburger, Lucien; Johrendt, Dirk","BaGe<sub>8</sub>As<sub>14</sub>: a semiconducting sodalite-type compound.","Chemical communications (Cambridge, England)","2021","57","11","1332","1335","10.1039/d0cc07813a","","","0.71073","MoKα","","0.0132","0.0123","","","0.0301","0.0303","","","","","","1.33","","","","has coordinates","262512","2021-03-05","01:24:04",""
"7127692","10.306","0.0002","10.306","0.0002","10.306","0.0002","90","","90","","90","","1094.64","0.04","218","2","218","2","","","","","","","","3","I -4 3 m","I -4 2 3","217","","","","- As14 Ba Ge8 -","- As14 Ba Ge8 -","- As28 Ba2 Ge16 -","2","0.0416667","","Weippert, Valentin; Chau, Thanh; Witthaut, Kristian; Eisenburger, Lucien; Johrendt, Dirk","BaGe<sub>8</sub>As<sub>14</sub>: a semiconducting sodalite-type compound.","Chemical communications (Cambridge, England)","2021","57","11","1332","1335","10.1039/d0cc07813a","","","0.71073","MoKα","","0.012","0.0116","","","0.0373","0.0374","","","","","","1.418","","","","has coordinates","262512","2021-03-05","01:24:04",""
"7127693","10.3052","0.0002","10.3052","0.0002","10.3052","0.0002","90","","90","","90","","1094.38","0.04","189","2","189","2","","","","","","","","3","I -4 3 m","I -4 2 3","217","","","","- As14 Ba Ge8 -","- As14 Ba Ge8 -","- As28 Ba2 Ge16 -","2","0.0416667","","Weippert, Valentin; Chau, Thanh; Witthaut, Kristian; Eisenburger, Lucien; Johrendt, Dirk","BaGe<sub>8</sub>As<sub>14</sub>: a semiconducting sodalite-type compound.","Chemical communications (Cambridge, England)","2021","57","11","1332","1335","10.1039/d0cc07813a","","","0.71073","MoKα","","0.0119","0.0119","","","0.0366","0.0366","","","","","","1.431","","","","has coordinates","262512","2021-03-05","01:24:04",""
"7127694","10.2967","0.0002","10.2967","0.0002","10.2967","0.0002","90","","90","","90","","1091.68","0.04","103","2","103","2","","","","","","","","3","I -4 3 m","I -4 2 3","217","","","","- As14 Ba Ge8 -","- As14 Ba Ge8 -","- As28 Ba2 Ge16 -","2","0.0416667","","Weippert, Valentin; Chau, Thanh; Witthaut, Kristian; Eisenburger, Lucien; Johrendt, Dirk","BaGe<sub>8</sub>As<sub>14</sub>: a semiconducting sodalite-type compound.","Chemical communications (Cambridge, England)","2021","57","11","1332","1335","10.1039/d0cc07813a","","","0.71073","MoKα","","0.0121","0.0119","","","0.0345","0.0346","","","","","","1.351","","","","has coordinates","262512","2021-03-05","01:24:04",""
"7127695","10.3018","0.0002","10.3018","0.0002","10.3018","0.0002","90","","90","","90","","1093.3","0.04","143","2","143","2","","","","","","","","3","I -4 3 m","I -4 2 3","217","","","","- As14 Ba Ge8 -","- As14 Ba Ge8 -","- As28 Ba2 Ge16 -","2","0.0416667","","Weippert, Valentin; Chau, Thanh; Witthaut, Kristian; Eisenburger, Lucien; Johrendt, Dirk","BaGe<sub>8</sub>As<sub>14</sub>: a semiconducting sodalite-type compound.","Chemical communications (Cambridge, England)","2021","57","11","1332","1335","10.1039/d0cc07813a","","","0.71073","MoKα","","0.0119","0.0117","","","0.0364","0.0364","","","","","","1.468","","","","has coordinates","262512","2021-03-05","01:24:04",""
"7127696","17.594","0.003","28.869","0.006","26.289","0.005","90","","90","","90","","13353","4","173","2","173","2","","","","","","","","6","C m c e","-C 2ac 2","64","","","","- C67 H56 F18 Hf7 O24 P8 -","- C67 H56 F18 Hf7 O24 P8 -","- C268 H224 F72 Hf28 O96 P32 -","4","0.25","","Huang, Yan; Zhou, Fan; Feng, Jianshen; Zhao, Hongxia; Qi, Chao; Ji, Jinyan; Bao, Songsong; Zheng, Tao","An ultra-stable hafnium phosphonate MOF platform for comparing the proton conductivity of various guest molecules/ions.","Chemical communications (Cambridge, England)","2021","57","10","1238","1241","10.1039/d0cc07375j","","","0.71073","MoKα","","0.1179","0.1056","","","0.2973","0.3109","","","","","","1.026","","","","has coordinates,has disorder","262469","2021-03-05","01:15:12",""
"7127697","13.1586","0.0007","17.0373","0.001","18.2948","0.001","90","","90","","90","","4101.5","0.4","100","2","100.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C48 H40 Au B Cl2 N6 -","- C48 H40 Au B Cl2 N6 -","- C192 H160 Au4 B4 Cl8 N24 -","4","1","","Wu, Jiang; Noonikara-Poyil, Anurag; Muñoz-Castro, Alvaro; Dias, H. V. Rasika","Gold(I) ethylene complexes supported by electron-rich scorpionates.","Chemical communications (Cambridge, England)","2021","57","8","978","981","10.1039/d0cc07717h","","","0.71073","MoKα","","0.0262","0.0242","","","0.0537","0.0545","","","","","","1.016","","","","has coordinates","261530","2021-02-04","22:29:50",""
"7127698","10.485","0.002","10.623","0.002","18.198","0.004","104.587","0.003","92.945","0.003","102.963","0.003","1899.1","0.7","100","2","100.15","","","","","","","","","5","P -1","-P 1","2","","","","- C35 H62 Au B N6 -","- C35 H62 Au B N6 -","- C70 H124 Au2 B2 N12 -","2","1","","Wu, Jiang; Noonikara-Poyil, Anurag; Muñoz-Castro, Alvaro; Dias, H. V. Rasika","Gold(I) ethylene complexes supported by electron-rich scorpionates.","Chemical communications (Cambridge, England)","2021","57","8","978","981","10.1039/d0cc07717h","","","0.71073","MoKα","","0.0308","0.0297","","","0.0792","0.08","","","","","","1.046","","","","has coordinates","261530","2021-02-04","22:30:07",""
"7127699","11.1251","0.0004","11.5573","0.0004","14.9248","0.0005","68.629","0.002","78.582","0.002","61.274","0.002","1566.48","0.1","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C64 H38 O22 Tb3 -","- C64 H38 O22 Tb3 -","- C64 H38 O22 Tb3 -","1","0.5","","Li, Meiling; Ren, Guojian; Yang, Weiting; Yang, Yonghang; Yang, Weikang; Gao, Yan; Qiu, Pengfei; Pan, Qinhe","Dual-emitting piezofluorochromic dye@MOF for white-light generation.","Chemical communications (Cambridge, England)","2021","57","11","1340","1343","10.1039/d0cc06478e","","","1.54178","CuKα","","0.1193","0.0971","","","0.2691","0.2936","","","","","","1.06","","","","has coordinates,has disorder","262516","2021-03-05","01:24:46",""
"7127700","8.791","0.004","9.87","0.005","17.284","0.009","80.231","0.016","84.537","0.019","68.486","0.013","1374.1","1.2","93","","93","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H33 As Au Cl O6 -","- C28 H33 As Au Cl O6 -","- C56 H66 As2 Au2 Cl2 O12 -","2","1","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71075","MoKα","","0.0505","0.0434","","","0.0943","0.0986","","","","","","0.874","","","","has coordinates","262479","2021-03-05","01:18:06",""
"7127701","9.108","0.005","13.445","0.007","15.796","0.008","70.4","0.014","84.367","0.011","85.551","0.012","1811.4","1.7","93","","93","","","","","","","","","9","P -1","-P 1","2","","","","- C29 H35 As Au Cl3 F6 Na O6 P -","- C29 H35 As Au Cl3 F6 Na O6 P -","- C58 H70 As2 Au2 Cl6 F12 Na2 O12 P2 -","2","1","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71075","MoKα","","0.0302","0.0277","","","0.0582","0.0593","","","","","","1.121","","","","has coordinates","262479","2021-03-05","01:18:07",""
"7127702","12.303","0.002","20.735","0.002","9.1248","0.0013","90","","110.263","0.006","90","","2183.7","0.5","93","","93","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H25 As O4 -","- C24 H25 As O4 -","- C96 H100 As4 O16 -","4","1","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71075","MoKα","","0.0384","0.0346","","","0.0875","0.0902","","","","","","1.07","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127703","11.163","0.005","12.784","0.005","13.105","0.006","70.933","0.013","79.936","0.013","78.162","0.015","1718.2","1.3","93","","93","","","","","","","","","8","P -1","-P 1","2","","","","- C29 H35 As Cl2 F6 Li O7 P -","- C29 H35 As Cl2 F6 Li O7 P -","- C58 H70 As2 Cl4 F12 Li2 O14 P2 -","2","1","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71075","MoKα","","0.0367","0.0337","","","0.0859","0.0883","","","","","","1.042","","","","has coordinates","262479","2021-03-05","01:18:07",""
"7127704","22.1368","0.001","7.4077","0.0003","21.7648","0.0008","90","","90.278","0.004","90","","3569","0.3","93.15","","93.15","","","","","","","","","5","I 1 2 1","I 2y","5","","","","- C81 H78 As4 Cl2 O8 -","- C81 H78 As4 Cl2 O8 -","- C162 H156 As8 Cl4 O16 -","2","0.5","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71073","MoKα","","0.0587","0.0571","","","0.1667","0.1679","","","","","","1.135","","","","has coordinates","262479","2021-03-05","01:18:07",""
"7127705","8.795","0.006","10.171","0.007","13.223","0.009","94.097","0.003","102.5","0.009","110.848","0.008","1064.8","1.3","93","","93","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H21 As Au Cl O3 -","- C22 H21 As Au Cl O3 -","- C44 H42 As2 Au2 Cl2 O6 -","2","1","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71075","MoKα","","0.0382","0.0348","","","0.0745","0.0754","","","","","","0.848","","","","has coordinates","262479","2021-03-05","01:18:07",""
"7127706","10.898","0.006","15.024","0.008","19.48","0.01","75.414","0.011","83.884","0.013","88.235","0.015","3069","3","93.15","","93.15","","","","","","","","","7","P -1","-P 1","2","","","","- C28 H33 As F6 K O6 P -","- C28 H33 As F6 K O6 P -","- C112 H132 As4 F24 K4 O24 P4 -","4","2","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71075","MoKα","","0.0394","0.0353","","","0.089","0.0922","","","","","","1.043","","","","has coordinates,has disorder","262479","2021-03-05","01:18:07",""
"7127707","8.416","0.005","16.272","0.009","27.383","0.015","90","","90","","90","","3750","4","93","","93","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H21 As O3 -","- C22 H21 As O3 -","- C176 H168 As8 O24 -","8","1","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71075","MoKα","","0.0706","0.0505","","","0.0976","0.1068","","","","","","1.117","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127708","10.893","0.004","15.216","0.005","19.475","0.007","75.108","0.008","84.069","0.007","87.759","0.009","3102.6","1.9","93","","93","","","","","","","","","7","P -1","-P 1","2","","","","- C28 H33 As F6 O6 P Rb -","- C28 H33 As F6 O6 P Rb -","- C112 H132 As4 F24 O24 P4 Rb4 -","4","2","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71075","MoKα","","0.114","0.0957","","","0.2721","0.2874","","","","","","1.036","","","","has coordinates","262479","2021-03-05","01:18:07",""
"7127709","10.866","0.009","14.725","0.013","21.75","0.02","71.84","0.03","78.83","0.04","71.16","0.03","3113","5","93","","93","","","","","","","","","7","P -1","-P 1","2","","","","- C28 H33 As F6 Na O6 P -","- C28 H33 As F6 Na O6 P -","- C112 H132 As4 F24 Na4 O24 P4 -","4","2","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71075","MoKα","","0.1434","0.1082","","","0.2318","0.2511","","","","","","1.048","","","","has coordinates,has disorder","262479","2021-03-05","01:18:07",""
"7127710","16.789","0.01","8.99","0.005","18.133","0.01","90","","98.208","0.007","90","","2709","3","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 As Au Cl3 O4 -","- C25 H27 As Au Cl3 O4 -","- C100 H108 As4 Au4 Cl12 O16 -","4","1","","Sumida, Akifumi; Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Dibenzoarsacrowns: an experimental and computational study on the coordination behaviors.","Chemical communications (Cambridge, England)","2021","57","16","2013","2016","10.1039/d0cc07191a","","","0.71075","MoKα","","0.1179","0.075","","","0.1804","0.2032","","","","","","1.098","","","","has coordinates","262479","2021-03-05","01:18:07",""
"7127711","11.6024","0.0004","12.4641","0.0004","17.0448","0.0005","111.154","0.003","91.945","0.003","97.305","0.003","2271.64","0.14","172.99","0.1","172.99","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C55 H60 B2 N2 O -","- C55 H60 B2 N2 O -","- C110 H120 B4 N4 O2 -","2","1","","Guo, Rui; Jiang, Jingxing; Ke, Zhuofeng; Tung, Chen-Ho; Kong, Lingbing","Incorporation of H<sub>2</sub>O and CO<sub>2</sub> into a BN-embedded 3<i>aH</i>-3<i>a</i><sup>1</sup><i>H</i>-acephenanthrylene derivative.","Chemical communications (Cambridge, England)","2021","57","10","1226","1229","10.1039/d0cc07276a","","x-ray","1.5478","CuKα","","0.082","0.0618","","","0.148","0.1601","","","","","","1.074","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127712","8.1757","0.0003","13.4922","0.0006","19.8843","0.0008","86.111","0.004","83.103","0.003","72.919","0.004","2080.25","0.15","172.99","0.1","172.99","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C52 H53 B2 N2 O2 -","- C52 H53 B2 N2 O2 -","- C104 H106 B4 N4 O4 -","2","1","","Guo, Rui; Jiang, Jingxing; Ke, Zhuofeng; Tung, Chen-Ho; Kong, Lingbing","Incorporation of H<sub>2</sub>O and CO<sub>2</sub> into a BN-embedded 3<i>aH</i>-3<i>a</i><sup>1</sup><i>H</i>-acephenanthrylene derivative.","Chemical communications (Cambridge, England)","2021","57","10","1226","1229","10.1039/d0cc07276a","","x-ray","1.54184","CuKα","","0.1087","0.0743","","","0.1964","0.2211","","","","","","1.04","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127713","11.1752","0.0004","14.786","0.0005","21.3743","0.0007","81.94","0.003","77.947","0.003","88.914","0.003","3419.6","0.2","173","0.1","173","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C77 H72 B3 F15 N4 O -","- C77 H72 B3 F15 N4 O -","- C154 H144 B6 F30 N8 O2 -","2","1","","Guo, Rui; Jiang, Jingxing; Ke, Zhuofeng; Tung, Chen-Ho; Kong, Lingbing","Incorporation of H<sub>2</sub>O and CO<sub>2</sub> into a BN-embedded 3<i>aH</i>-3<i>a</i><sup>1</sup><i>H</i>-acephenanthrylene derivative.","Chemical communications (Cambridge, England)","2021","57","10","1226","1229","10.1039/d0cc07276a","","x-ray","1.54184","CuKα","","0.0544","0.042","","","0.1074","0.123","","","","","","1.075","","","","has coordinates","301860","2025-08-22","09:26:53",""
"7127714","13.8176","0.0003","12.4115","0.0002","23.4669","0.0004","90","","97.207","0.007","90","","3992.71","0.14","200","2","200","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C18 H48 N10 O16 Pd Rh2 S6 -","- C18 H48 N10 O16 Pd Rh2 S6 -","- C72 H192 N40 O64 Pd4 Rh8 S24 -","4","1","","Kouno, Masahiro; Kuwamura, Naoto; Konno, Takumi","Interconversion between square-planar palladium(ii) and octahedral palladium(iv) centres in a sulfur-bridged trinuclear structure.","Chemical communications (Cambridge, England)","2021","57","11","1336","1339","10.1039/d0cc07490j","","","0.71075","MoKα","","0.0258","0.0239","","","0.0606","0.0632","","","","","","1.06","","","","has coordinates","262510","2021-03-05","01:23:44",""
"7127715","9.056","0.0018","12.029","0.002","17.767","0.004","90","","104.27","0.03","90","","1875.7","0.7","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H48 N8 O14 Pd Rh2 S6 -","- C18 H48 N8 O14 Pd Rh2 S6 -","- C36 H96 N16 O28 Pd2 Rh4 S12 -","2","0.5","","Kouno, Masahiro; Kuwamura, Naoto; Konno, Takumi","Interconversion between square-planar palladium(ii) and octahedral palladium(iv) centres in a sulfur-bridged trinuclear structure.","Chemical communications (Cambridge, England)","2021","57","11","1336","1339","10.1039/d0cc07490j","","","0.63","synchrotron","","0.0412","0.0391","","","0.111","0.1126","","","","","","1.126","","","","has coordinates","262510","2021-03-05","01:23:44",""
"7127716","21.241","0.003","20.717","0.003","20.087","0.003","90","","120.014","0.008","90","","7654","2","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C18 H48 Ag N9 O12 Pd Rh2 S6 -","- C18 H48 Ag N9 O12 Pd Rh2 S6 -","- C144 H384 Ag8 N72 O96 Pd8 Rh16 S48 -","8","1","","Kouno, Masahiro; Kuwamura, Naoto; Konno, Takumi","Interconversion between square-planar palladium(ii) and octahedral palladium(iv) centres in a sulfur-bridged trinuclear structure.","Chemical communications (Cambridge, England)","2021","57","11","1336","1339","10.1039/d0cc07490j","","","0.7004","synchrotron","","0.144","0.0841","","","0.2268","0.2686","","","","","","0.997","","","","has coordinates","262510","2021-03-05","01:23:44",""
"7127717","9.5252","0.0012","13.7778","0.0018","27.631","0.004","102.207","0.007","96.462","0.007","98.213","0.007","3469.4","0.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H48 N8 O8.5 Pd Rh2 S6 -","- C18 H48 N8 O8.5 Pd Rh2 S6 -","- C72 H192 N32 O34 Pd4 Rh8 S24 -","4","2","","Kouno, Masahiro; Kuwamura, Naoto; Konno, Takumi","Interconversion between square-planar palladium(ii) and octahedral palladium(iv) centres in a sulfur-bridged trinuclear structure.","Chemical communications (Cambridge, England)","2021","57","11","1336","1339","10.1039/d0cc07490j","","","0.7004","synchrotron","","0.2074","0.1011","","","0.228","0.2887","","","","","","1.04","","","","has coordinates,has disorder","262510","2021-03-05","01:23:44",""
"7127767","12.3636","0.0017","13.1822","0.0017","22.28","0.003","90","","100.247","0.003","90","","3573.3","0.8","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1a","","- C46 H35 B F2 N2 -","- C46 H35 B F2 N2 -","- C184 H140 B4 F8 N8 -","4","1","","Wang, Sisi; Wang, Zhaoli; Gao, Hu; Jiang, Liang; Liu, Hui; Wu, Fan; Zhao, Yue; Chan, Kin Shing; Shen, Zhen","Highly regioselective palladium-catalyzed domino reaction for post-functionalization of BODIPY.","Chemical communications (Cambridge, England)","2021","57","14","1758","1761","10.1039/d0cc08163a","","","0.71073","MoKα","","0.0707","0.049","","","0.1236","0.1378","","","","","","0.973","","","","has coordinates","262494","2021-03-05","01:21:04",""
"7127768","12.6316","0.0007","21.8885","0.0014","14.3585","0.0008","90","","103.515","0.006","90","","3860","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2d","","- C50 H43 B F2 N2 -","- C50 H43 B F2 N2 -","- C200 H172 B4 F8 N8 -","4","1","","Wang, Sisi; Wang, Zhaoli; Gao, Hu; Jiang, Liang; Liu, Hui; Wu, Fan; Zhao, Yue; Chan, Kin Shing; Shen, Zhen","Highly regioselective palladium-catalyzed domino reaction for post-functionalization of BODIPY.","Chemical communications (Cambridge, England)","2021","57","14","1758","1761","10.1039/d0cc08163a","","","0.71073","MoKα","","0.1176","0.086","","","0.1633","0.1849","","","","","","1.069","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127769","15.7803","0.0006","16.9989","0.0006","21.4911","0.0008","90.149","0.002","91.366","0.002","90.205","0.002","5763.2","0.4","189.99","","189.99","","","","","","","","","5","P -1","-P 1","2","","","","- C136 H142 B2 F4 N4 -","- C136 H142 B2 F4 N4 -","- C272 H284 B4 F8 N8 -","2","1","","Wang, Sisi; Wang, Zhaoli; Gao, Hu; Jiang, Liang; Liu, Hui; Wu, Fan; Zhao, Yue; Chan, Kin Shing; Shen, Zhen","Highly regioselective palladium-catalyzed domino reaction for post-functionalization of BODIPY.","Chemical communications (Cambridge, England)","2021","57","14","1758","1761","10.1039/d0cc08163a","","","1.34138","GaKα","","0.1041","0.0732","","","0.1943","0.2243","","","","","","1.047","","","","has coordinates,has disorder","262494","2021-03-05","01:21:06",""
"7127770","5.8457","0.0008","8.1317","0.0009","16.63","0.002","102.41","0.004","91.559","0.005","99.457","0.005","759.95","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H15 N O4 S -","- C17 H15 N O4 S -","- C34 H30 N2 O8 S2 -","2","1","","Wang, Jingjing; Liu, Xue; Wu, Ziyan; Li, Feng; Zhang, Ming-Liang; Mi, Yiman; Wei, Junhao; Zhou, Yao; Liu, Lantao","Ag-Catalyzed ring-opening of tertiary cycloalkanols for C-H functionalization of cyclic aldimines.","Chemical communications (Cambridge, England)","2021","57","12","1506","1509","10.1039/d0cc07181a","","","0.71073","MoKα","","0.0426","0.0342","","","0.0904","0.0947","","","","","","1.044","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127771","16.556","0.002","5.6598","0.0007","17.572","0.002","90","","115.833","0.004","90","","1482","0.3","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H13 N O4 S -","- C16 H13 N O4 S -","- C64 H52 N4 O16 S4 -","4","1","","Wang, Jingjing; Liu, Xue; Wu, Ziyan; Li, Feng; Zhang, Ming-Liang; Mi, Yiman; Wei, Junhao; Zhou, Yao; Liu, Lantao","Ag-Catalyzed ring-opening of tertiary cycloalkanols for C-H functionalization of cyclic aldimines.","Chemical communications (Cambridge, England)","2021","57","12","1506","1509","10.1039/d0cc07181a","","","0.71073","MoKα","","0.1062","0.0588","","","0.1191","0.1332","","","","","","1.072","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127772","8.911","0.0005","11.1675","0.0006","11.8597","0.0007","108.483","0.0015","97.6582","0.0016","100.322","0.0015","1078.12","0.11","103","2","103","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H42 Cl8 Ni2 O14 P2 -","- C32 H42 Cl8 Ni2 O14 P2 -","- C32 H42 Cl8 Ni2 O14 P2 -","1","0.5","","Yang, Xin; Wei, Rui; Shi, Yaping; Liu, Liu Leo; Wu, Yile; Zhao, Yufen; Stephan, Douglas W.","Oxyphosphoranes as precursors to bridging phosphate-catecholate ligands.","Chemical communications (Cambridge, England)","2021","57","10","1194","1197","10.1039/d0cc07736d","","","1.54178","CuKα","","0.0329","0.0325","","","0.0853","0.0856","","","","","","1.06","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127773","9.6112","0.0005","11.6372","0.0006","18.137","0.001","90","","99.301","0.002","90","","2001.91","0.18","100","2","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 Cl6 O6 P Zr -","- C12 H13 Cl6 O6 P Zr -","- C48 H52 Cl24 O24 P4 Zr4 -","4","1","","Yang, Xin; Wei, Rui; Shi, Yaping; Liu, Liu Leo; Wu, Yile; Zhao, Yufen; Stephan, Douglas W.","Oxyphosphoranes as precursors to bridging phosphate-catecholate ligands.","Chemical communications (Cambridge, England)","2021","57","10","1194","1197","10.1039/d0cc07736d","","","1.54178","CuKα","","0.0306","0.0291","","","0.0777","0.0787","","","","","","1.073","","","","has coordinates","262468","2021-03-05","01:15:01",""
"7127774","12.0697","0.0006","12.2097","0.0006","16.6508","0.0008","72.379","0.001","73.271","0.001","60.546","0.001","2007.62","0.17","199","2","199","","","","","","","","","6","P -1","-P 1","2","","","","- C2.82 H3.53 Cl1.18 O1.65 P0.24 V0.24 -","- C2.82353 H3.52941 Cl1.17647 O1.64706 P0.235294 V0.235294 -","- C48 H60 Cl20 O28 P4 V4 -","17","8.5","","Yang, Xin; Wei, Rui; Shi, Yaping; Liu, Liu Leo; Wu, Yile; Zhao, Yufen; Stephan, Douglas W.","Oxyphosphoranes as precursors to bridging phosphate-catecholate ligands.","Chemical communications (Cambridge, England)","2021","57","10","1194","1197","10.1039/d0cc07736d","","","1.54178","CuKα","","0.0334","0.0331","","","0.0874","0.0876","","","","","","1.051","","","","has coordinates","262468","2021-03-05","01:15:01",""
"7127775","14.4834","0.0009","14.9881","0.0009","15.571","0.001","107.35","0.002","117.247","0.002","98.551","0.002","2701.5","0.3","100","2","100","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H58 Cl10 O16 P2 V2 -","- C40 H58 Cl10 O16 P2 V2 -","- C80 H116 Cl20 O32 P4 V4 -","2","1","","Yang, Xin; Wei, Rui; Shi, Yaping; Liu, Liu Leo; Wu, Yile; Zhao, Yufen; Stephan, Douglas W.","Oxyphosphoranes as precursors to bridging phosphate-catecholate ligands.","Chemical communications (Cambridge, England)","2021","57","10","1194","1197","10.1039/d0cc07736d","","","1.54178","CuKα","","0.0438","0.0424","","","0.1157","0.1174","","","","","","1.044","","","","has coordinates","262468","2021-03-05","01:15:01",""
"7127776","42.2108","0.0009","42.2108","0.0009","9.038","0.0003","90","","90","","120","","13946","0.6","150","0.1","150","0.1","","","","","","","","6","R -3 :H","-R 3","148","","","","- C26 H22 F10 Ir N7 P2 -","- C26 H22 F10 Ir N7 P -","- C468 H396 F180 Ir18 N126 P18 -","18","1","","Yang, Jing; Fang, Hao-Ji; Cao, Qian; Mao, Zong-Wan","The design of cyclometalated iridium(iii)-metformin complexes for hypoxic cancer treatment.","Chemical communications (Cambridge, England)","2021","57","9","1093","1096","10.1039/d0cc07104h","","","0.71073","MoKα","","0.0811","0.0654","","","0.1534","0.164","","","","","","1.012","","","","has coordinates","298703","2025-04-03","05:34:20",""
"7127777","20.5397","0.0008","42.5569","0.0012","8.5642","0.0004","90","","90.348","0.004","90","","7485.9","0.5","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","CPDC","hexakis(carboxyphenyl) tri(dithiolylidene)cyclohexanetrione","","- C73 H46 O19 S6 -","- C73 H46 O19 S6 -","- C292 H184 O76 S24 -","4","0.5","","Shivakumar, Kilingaru I.; Noro, Shin-Ichiro; Yamaguchi, Yuna; Ishigaki, Yusuke; Saeki, Akinori; Takahashi, Kiyonori; Nakamura, Takayoshi; Hisaki, Ichiro","A hydrogen-bonded organic framework based on redox-active tri(dithiolylidene)cyclohexanetrione.","Chemical communications (Cambridge, England)","2021","57","9","1157","1160","10.1039/d0cc07776c","","","1.54184","CuKα","","0.0992","0.0671","","","0.1813","0.2048","","","","","","1.006","","","","has coordinates,has disorder","261561","2021-02-04","22:43:06",""
"7127778","22.2753","0.0009","22.2753","0.0009","8.6405","0.0004","90","","90","","120","","3712.9","0.3","225","2","225","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C36 H51 Br6 N12 O12 Sb -","- C36 H51 Br6 N12 O12 Sb -","- C108 H153 Br18 N36 O36 Sb3 -","3","0.166667","","Lin, Fang; Wang, Hao; Lin, Haoran; Liu, Wei; Li, Jing","An antimony based organic-inorganic hybrid coating material with high quantum efficiency and thermal quenching effect.","Chemical communications (Cambridge, England)","2021","57","14","1754","1757","10.1039/d0cc07392j","","","1.34139","GaKα","","0.0542","0.054","","","0.1649","0.165","","","","","","1.124","","","","has coordinates","262498","2021-03-05","01:21:37",""
"7127779","7.6931","0.0007","17.523","0.0015","30.345","0.003","90","","90","","90","","4090.7","0.7","298","2","298","","","","","","","","","7","P c a b","-P 2bc 2ac","61","","","","- C20 H14 Br Cl Mn N3 O4 -","- C20 H14 Br Cl Mn N3 O4 -","- C160 H112 Br8 Cl8 Mn8 N24 O32 -","8","1","","Stenger-Smith, Jenny; Chakraborty, Indranil; Ouattara, Ramatoulaye; Sameera, W. M. C.; Rue, Kelly; Mascharak, Pradip","CO release from Mn(i)-based photoCORMs with single photons in the phototherapeutic region.","Chemical communications (Cambridge, England)","2021","57","9","1101","1104","10.1039/d0cc07405e","","","0.71073","MoKα","","0.1397","0.0796","","","0.1429","0.1625","","","","","","1.121","","","","has coordinates","261563","2021-02-04","22:44:00",""
"7127780","13.6697","0.0017","22.226","0.003","8.017","0.001","90","","99.76","0.003","90","","2400.5","0.5","150","","150","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C25.75 H18 Br1.25 Cl0.25 Mn N4 O2.75 S -","- C25.823 H18 Br1.177 Mn N4 O2.823 S -","- C103.292 H72 Br4.708 Mn4 N16 O11.292 S4 -","4","1","","Stenger-Smith, Jenny; Chakraborty, Indranil; Ouattara, Ramatoulaye; Sameera, W. M. C.; Rue, Kelly; Mascharak, Pradip","CO release from Mn(i)-based photoCORMs with single photons in the phototherapeutic region.","Chemical communications (Cambridge, England)","2021","57","9","1101","1104","10.1039/d0cc07405e","","","0.71073","MoKα","","0.1786","0.1002","","","0.1639","0.1929","","","","","","1.043","","","","has coordinates,has disorder","261563","2021-02-04","22:44:12",""
"7127781","8.3888","0.0011","9.2869","0.0012","23.322","0.004","90","","90","","90","","1816.9","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H15 Br N2 O2 -","- C20 H15 Br N2 O2 -","- C80 H60 Br4 N8 O8 -","4","1","","Wu, Hui-Chun; Wang, Chen; Chen, Ying-Han; Liu, Yan-Kai","Asymmetric organocatalytic vinylogous Michael addition triggered triple-cascade reactions of 2-hydroxycinnamaldehydes and vinylogous nucleophiles: construction of benzofused oxabicyclo[3.3.1]nonane scaffolds.","Chemical communications (Cambridge, England)","2021","57","14","1762","1765","10.1039/d0cc07761e","","","1.54184","CuKα","","0.1658","0.0831","","","0.1456","0.2058","","","","","","1.018","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127782","20.069","0.003","11.785","0.002","16.398","0.003","90","","97.014","0.002","90","","3849.3","1.1","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H44 Cl10 N8 Pb3 -","- C20 H40 Cl10 N8 Pb3 -","- C80 H160 Cl40 N32 Pb12 -","4","0.5","","Zhao, Jian-Qiang; Sun, Chen; Yue, Meng; Meng, Yan; Zhao, Xian-Mei; Zeng, Le-Ran; Chen, Guang; Yue, Cheng-Yang; Lei, Xiao-Wu","Lead chlorine cluster assembled one-dimensional halide with highly efficient broadband white-light emission.","Chemical communications (Cambridge, England)","2021","57","10","1218","1221","10.1039/d0cc05570k","","","0.71073","MoKα","","0.0339","0.0244","","","0.0499","0.0521","","","","","","1.033","","","","has coordinates","262471","2021-03-05","01:15:44",""
"7127783","11.8725","0.0002","16.7463","0.0003","42.5496","0.0008","90","","94.892","0.001","90","","8428.9","0.3","170","2","170.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C84 H87 Cl9 N12 -","- C84 H87 Cl9 N12 -","- C336 H348 Cl36 N48 -","4","1","","Xu, Kui; Zhang, Xiaoshuai; Liu, Guopeng; Ma, Wanzun; Yin, Yu; Yin, Ying; Chen, Xi; Zhao, Xinyun; Sessler, Jonathan L.; Zhang, Zhan","Pyridazine-bridged expanded rosarin and semi-rosarinogen.","Chemical communications (Cambridge, England)","2021","57","12","1486","1489","10.1039/d0cc07433k","","","1.34139","GaKα","","0.0895","0.0768","","","0.2152","0.226","","","","","","1.037","","","","has coordinates","262518","2021-03-05","01:25:57",""
"7127784","6.5368","0.0003","10.9882","0.0006","12.5935","0.0007","114.913","0.002","91.931","0.003","96.868","0.003","810.95","0.08","298.15","","298.15","","","","","","","","","7","P -1","-P 1","2","","","","- C16 H11 B Cl2 F2 N2 O -","- C16 H11 B Cl2 F2 N2 O -","- C32 H22 B2 Cl4 F4 N4 O2 -","2","1","","Li, Heng; Lv, Fan; Guo, Xing; Wu, Qinghua; Wu, Hao; Tang, Bing; Yu, Changjiang; Wang, Hua; Jiao, Lijuan; Hao, Erhong","Direct C-H alkoxylation of BODIPY dyes via cation radical accelerated oxidative nucleophilic hydrogen substitution: a new route to building blocks for functionalized BODIPYs.","Chemical communications (Cambridge, England)","2021","57","13","1647","1650","10.1039/d0cc07961h","","","0.71073","MoKα","","0.1326","0.1057","","","0.1693","0.1792","","","","","","1.26","","","","has coordinates","262491","2021-03-05","01:20:25",""
"7127785","7.0336","0.0002","11.3399","0.0004","14.7341","0.0005","70.182","0.001","78.632","0.001","82.152","0.001","1080.8","0.06","273.15","","273.15","","","","","","","","","7","P -1","-P 1","2","","","","- C22 H15 B Cl2 F2 N2 O -","- C22 H15 B Cl2 F2 N2 O -","- C44 H30 B2 Cl4 F4 N4 O2 -","2","1","","Li, Heng; Lv, Fan; Guo, Xing; Wu, Qinghua; Wu, Hao; Tang, Bing; Yu, Changjiang; Wang, Hua; Jiao, Lijuan; Hao, Erhong","Direct C-H alkoxylation of BODIPY dyes via cation radical accelerated oxidative nucleophilic hydrogen substitution: a new route to building blocks for functionalized BODIPYs.","Chemical communications (Cambridge, England)","2021","57","13","1647","1650","10.1039/d0cc07961h","","","0.71073","MoKα","","0.0764","0.0506","","","0.1308","0.1489","","","","","","1.036","","","","has coordinates","262491","2021-03-05","01:20:26",""
"7127786","14","0.0006","12.6326","0.0005","14.1556","0.0005","90","","112.884","0.002","90","","2306.47","0.16","273.15","","273.15","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C22 H15 B Cl2 F2 N2 O3 S -","- C22 H15 B Cl2 F2 N2 O3 S -","- C88 H60 B4 Cl8 F8 N8 O12 S4 -","4","1","","Li, Heng; Lv, Fan; Guo, Xing; Wu, Qinghua; Wu, Hao; Tang, Bing; Yu, Changjiang; Wang, Hua; Jiao, Lijuan; Hao, Erhong","Direct C-H alkoxylation of BODIPY dyes via cation radical accelerated oxidative nucleophilic hydrogen substitution: a new route to building blocks for functionalized BODIPYs.","Chemical communications (Cambridge, England)","2021","57","13","1647","1650","10.1039/d0cc07961h","","","0.71073","MoKα","","0.1184","0.0638","","","0.1368","0.1671","","","","","","1.019","","","","has coordinates","262491","2021-03-05","01:20:26",""
"7127787","10.1721","0.0004","9.702","0.0003","14.1513","0.0006","90","","109.467","0.004","90","","1316.75","0.09","294.82","0.1","294.82","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H22 F O2 P -","- C27 H22 F O2 P -","- C54 H44 F2 O4 P2 -","2","1","","Xie, Shaolei; He, Zhi-Juan; Zhang, Ling-Hui; Huang, Bo-Lun; Chen, Xiao-Wei; Zhan, Zong-Song; Zhang, Fu-Min","The organocatalytic enantiodivergent fluorination of β-ketodiaryl-phosphine oxides for the construction of carbon-fluorine quaternary stereocenters.","Chemical communications (Cambridge, England)","2021","57","16","2069","2072","10.1039/d0cc07770d","","x-ray","1.54184","CuKα","","0.0576","0.0433","","","0.0926","0.1005","","","","","","0.966","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127788","9.9203","0.0002","9.7787","0.0002","13.8908","0.0003","90","","103.935","0.002","90","","1307.86","0.05","172.9","0.1","172.9","0.1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28 H23 Cl3 F O2 P -","- C28 H23 Cl3 F O2 P -","- C56 H46 Cl6 F2 O4 P2 -","2","1","","Xie, Shaolei; He, Zhi-Juan; Zhang, Ling-Hui; Huang, Bo-Lun; Chen, Xiao-Wei; Zhan, Zong-Song; Zhang, Fu-Min","The organocatalytic enantiodivergent fluorination of β-ketodiaryl-phosphine oxides for the construction of carbon-fluorine quaternary stereocenters.","Chemical communications (Cambridge, England)","2021","57","16","2069","2072","10.1039/d0cc07770d","","x-ray","1.54184","CuKα","","0.0414","0.0404","","","0.1077","0.1089","","","","","","1.047","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127789","6.20266","0.00014","17.5076","0.0003","19.9155","0.0005","90","","90","","90","","2162.7","0.08","293.3","0.1","293.3","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H19 Br F O2 P -","- C26 H19 Br F O2 P -","- C104 H76 Br4 F4 O8 P4 -","4","1","","Xie, Shaolei; He, Zhi-Juan; Zhang, Ling-Hui; Huang, Bo-Lun; Chen, Xiao-Wei; Zhan, Zong-Song; Zhang, Fu-Min","The organocatalytic enantiodivergent fluorination of β-ketodiaryl-phosphine oxides for the construction of carbon-fluorine quaternary stereocenters.","Chemical communications (Cambridge, England)","2021","57","16","2069","2072","10.1039/d0cc07770d","","x-ray","1.54184","CuKα","","0.039","0.0344","","","0.0843","0.0877","","","","","","1.04","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127790","9.2255","0.0005","12.6121","0.0007","18.2822","0.0012","90","","90","","90","","2127.2","0.2","293.57","0.1","293.57","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H20 F O2 P -","- C26 H20 F O2 P -","- C104 H80 F4 O8 P4 -","4","1","","Xie, Shaolei; He, Zhi-Juan; Zhang, Ling-Hui; Huang, Bo-Lun; Chen, Xiao-Wei; Zhan, Zong-Song; Zhang, Fu-Min","The organocatalytic enantiodivergent fluorination of β-ketodiaryl-phosphine oxides for the construction of carbon-fluorine quaternary stereocenters.","Chemical communications (Cambridge, England)","2021","57","16","2069","2072","10.1039/d0cc07770d","","x-ray","1.54184","CuKα","","0.0879","0.081","","","0.2258","0.2369","","","","","","1.069","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127791","6.2073","0.0003","17.5063","0.0006","19.9264","0.0009","90","","90","","90","","2165.34","0.16","293.44","0.1","293.44","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H19 Br F O2 P -","- C26 H19 Br F O2 P -","- C104 H76 Br4 F4 O8 P4 -","4","1","","Xie, Shaolei; He, Zhi-Juan; Zhang, Ling-Hui; Huang, Bo-Lun; Chen, Xiao-Wei; Zhan, Zong-Song; Zhang, Fu-Min","The organocatalytic enantiodivergent fluorination of β-ketodiaryl-phosphine oxides for the construction of carbon-fluorine quaternary stereocenters.","Chemical communications (Cambridge, England)","2021","57","16","2069","2072","10.1039/d0cc07770d","","x-ray","1.54184","CuKα","","0.0432","0.0323","","","0.0686","0.0778","","","","","","0.991","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127792","9.4706","0.0007","12.3535","0.0014","19.12","0.002","90","","90","","90","","2236.9","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H22 F O2 P -","- C27 H22 F O2 P -","- C108 H88 F4 O8 P4 -","4","1","","Xie, Shaolei; He, Zhi-Juan; Zhang, Ling-Hui; Huang, Bo-Lun; Chen, Xiao-Wei; Zhan, Zong-Song; Zhang, Fu-Min","The organocatalytic enantiodivergent fluorination of β-ketodiaryl-phosphine oxides for the construction of carbon-fluorine quaternary stereocenters.","Chemical communications (Cambridge, England)","2021","57","16","2069","2072","10.1039/d0cc07770d","","x-ray","1.54184","CuKα","","0.0748","0.0532","","","0.1382","0.1728","","","","","","1.098","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127793","10.0306","0.0003","9.5877","0.0002","14.074","0.0004","90","","109.455","0.003","90","","1276.22","0.06","292.31","0.1","292.31","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H25 F2 O3 P -","- C29 H25 F2 O3 P -","- C58 H50 F4 O6 P2 -","2","1","","Xie, Shaolei; He, Zhi-Juan; Zhang, Ling-Hui; Huang, Bo-Lun; Chen, Xiao-Wei; Zhan, Zong-Song; Zhang, Fu-Min","The organocatalytic enantiodivergent fluorination of β-ketodiaryl-phosphine oxides for the construction of carbon-fluorine quaternary stereocenters.","Chemical communications (Cambridge, England)","2021","57","16","2069","2072","10.1039/d0cc07770d","","x-ray","1.54184","CuKα","","0.0395","0.0355","","","0.0934","0.0976","","","","","","1.053","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127794","8.021","0.0006","9.7257","0.0008","11.0936","0.0008","81.88","0.006","81.526","0.006","66.712","0.008","782.94","0.11","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C18 H18 F O2 P -","- C18 H18 F O2 P -","- C36 H36 F2 O4 P2 -","2","2","","Xie, Shaolei; He, Zhi-Juan; Zhang, Ling-Hui; Huang, Bo-Lun; Chen, Xiao-Wei; Zhan, Zong-Song; Zhang, Fu-Min","The organocatalytic enantiodivergent fluorination of β-ketodiaryl-phosphine oxides for the construction of carbon-fluorine quaternary stereocenters.","Chemical communications (Cambridge, England)","2021","57","16","2069","2072","10.1039/d0cc07770d","","x-ray","1.54184","CuKα","","0.0603","0.0573","","","0.1652","0.1694","","","","","","1.061","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127795","7.3707","0.0001","10.3546","0.0001","8.6086","0.0001","90","","108.874","0.001","90","","621.688","0.013","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","","(3aR,8bR)-3a-phenyl-3,3a,5,8b-tetrahydro-1H-furo[3,2-d]thieno[3,4-b]pyran","","- C15 H14 O2 S -","- C15 H14 O2 S -","- C30 H28 O4 S2 -","2","1","","Skrzyńska, Anna; Frankowski, Sebastian; Topolska, Aleksandra; Dyguda, Mateusz; Gao, Xin-Yue; Xu, Chang-Jiang; Chen, Ying-Chun; Albrecht, Łukasz","Enantioselective H-bond-directed vinylogous iminium ion strategy for the functionalization of vinyl-substituted heteroaryl aldehydes.","Chemical communications (Cambridge, England)","2021","57","13","1667","1670","10.1039/d0cc07765h","","x-ray","1.54184","CuKα","","0.0194","0.0194","","","0.0511","0.0511","","","","","","1.054","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127796","8.0197","0.0001","9.6836","0.0001","10.155","0.0002","63.873","0.002","83.678","0.001","84.07","0.001","702.42","0.02","100","","100","","","","","","","","","4","P 1","P 1","1","","(3R,4R)-4-(2-(hydroxymethyl)thiophen-3-yl)-3-phenyltetrahydrothiophen-3-ol","","- C15 H16 O2 S2 -","- C15 H16 O2 S2 -","- C30 H32 O4 S4 -","2","2","","Skrzyńska, Anna; Frankowski, Sebastian; Topolska, Aleksandra; Dyguda, Mateusz; Gao, Xin-Yue; Xu, Chang-Jiang; Chen, Ying-Chun; Albrecht, Łukasz","Enantioselective H-bond-directed vinylogous iminium ion strategy for the functionalization of vinyl-substituted heteroaryl aldehydes.","Chemical communications (Cambridge, England)","2021","57","13","1667","1670","10.1039/d0cc07765h","","x-ray","1.54184","CuKα","","0.0293","0.0293","","","0.0738","0.0738","","","","","","1.047","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127797","7.3649","0.0007","10.1031","0.0009","12.6796","0.0011","73.123","0.001","89.989","0.002","85.119","0.002","899.26","0.14","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H10 Br Cl3 O -","- C19 H10 Br Cl3 O -","- C38 H20 Br2 Cl6 O2 -","2","1","","Wu, Dan; Hao, Wen-Juan; Rao, Qian; Lu, Yi; Tu, Shu-Jiang; Jiang, Bo","Engaging 1,7-diynes in a photocatalytic Kharasch-type addition/1,5-(S<sub>N</sub>'')-substitution cascade toward β-gem-dihalovinyl carbonyls.","Chemical communications (Cambridge, England)","2021","57","15","1911","1914","10.1039/d0cc07880h","","","0.71073","MoKα","","0.1012","0.0635","","","0.169","0.1806","","","","","","1.039","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127798","9.0114","0.0008","10.0086","0.0009","12.9721","0.0011","99.895","0.002","92.668","0.001","107.318","0.003","1094.37","0.17","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H17 Br Cl F2 I O3 -","- C22 H17 Br Cl F2 I O3 -","- C44 H34 Br2 Cl2 F4 I2 O6 -","2","1","","Wu, Dan; Hao, Wen-Juan; Rao, Qian; Lu, Yi; Tu, Shu-Jiang; Jiang, Bo","Engaging 1,7-diynes in a photocatalytic Kharasch-type addition/1,5-(S<sub>N</sub>'')-substitution cascade toward β-gem-dihalovinyl carbonyls.","Chemical communications (Cambridge, England)","2021","57","15","1911","1914","10.1039/d0cc07880h","","","0.71073","MoKα","","0.0838","0.0642","","","0.1806","0.1958","","","","","","1.056","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127799","19.8031","0.0011","22.211","0.0012","17.0555","0.0009","90","","96.387","0.002","90","","7455.2","0.7","173","2","173","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36.5 H32 Cl4 F3 O P2 Re -","- C36.5 H32 Cl4 F3 O P2 Re -","- C292 H256 Cl32 F24 O8 P16 Re8 -","8","1","","Bao, Xiao; Li, Yang; Bai, Wei; Zhou, Yan; Wang, Yilun; Sun, Yue; Jiang, Jingyang","One-pot syntheses of rhena-2-benzopyrylium complexes with a fused metallacyclopropene unit.","Chemical communications (Cambridge, England)","2021","57","13","1643","1646","10.1039/d0cc07749f","","","0.71073","MoKα","","0.1042","0.0556","","","0.1157","0.1278","","","","","","1.01","","","","has coordinates,has disorder","262492","2021-03-05","01:20:37",""
"7127800","17.1481","0.0006","11.9633","0.0007","17.0822","0.0006","90","","108.29","0.004","90","","3327.3","0.3","173","2","173.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 Cl3 O P2 Re -","- C36 H34 Cl3 O P2 Re -","- C144 H136 Cl12 O4 P8 Re4 -","4","1","","Bao, Xiao; Li, Yang; Bai, Wei; Zhou, Yan; Wang, Yilun; Sun, Yue; Jiang, Jingyang","One-pot syntheses of rhena-2-benzopyrylium complexes with a fused metallacyclopropene unit.","Chemical communications (Cambridge, England)","2021","57","13","1643","1646","10.1039/d0cc07749f","","x-ray","0.71073","MoKα","","0.0387","0.0303","","","0.0664","0.0693","","","","","","1.023","","","","has coordinates","262492","2021-03-05","01:20:37",""
"7127801","14.1901","0.0008","13.1981","0.0009","9.2973","0.0006","90","","103.858","0.006","90","","1690.54","0.19","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H14 Cl F N O -","- C21 H13 Cl F N O -","- C84 H52 Cl4 F4 N4 O4 -","4","1","","Gao, Chao; Xu, Jian; Zhu, Shuxian; Jian, Kaixia; Xuan, Qingqing; Song, Qiuling","Preparation of anthranils via chemoselective oxidative radical cyclization of 3-(2-azidoaryl) substituted propargyl alcohols.","Chemical communications (Cambridge, England)","2021","57","16","2037","2040","10.1039/d0cc07919g","","x-ray","0.71073","MoKα","","0.1221","0.0549","","","0.1406","0.1912","","","","","","0.92","","","","has coordinates","262480","2021-03-05","01:18:14",""
"7127802","27.083","0.003","8.0051","0.001","15.9067","0.0019","90","","90","","90","","3448.6","0.7","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","dDTCB","","- C36 H12 B2 F18 S4 -","- C36 H12 B2 F18 S4 -","- C144 H48 B8 F72 S16 -","4","0.5","","Adachi, Yohei; Nomura, Takanori; Tazuhara, Shion; Naito, Hiroyoshi; Ohshita, Joji","Thiophene-based twisted bistricyclic aromatic ene with tricoordinate boron: a new n-type semiconductor.","Chemical communications (Cambridge, England)","2021","57","11","1316","1319","10.1039/d0cc07952a","","","0.71073","MoKa","","0.0473","0.0402","","","0.0954","0.0995","","","","","","1.118","","","","has coordinates","262513","2021-03-05","01:24:11",""
"7127803","11.994","0.004","12.841","0.005","16.952","0.006","96.769","0.008","100.451","0.008","97.043","0.008","2521.8","1.6","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H22 Br N2 O2.5 -","- C31 H22 Br N2 O2.5 -","- C124 H88 Br4 N8 O10 -","4","2","","Edukondalu, Athukuri; Vagh, Sandip Sambhaji; Lin, Ting-Han; Lin, Wenwei","Construction of indeno[1,2-b]pyrroles via chemoselective N-acylation/cyclization/Wittig reaction sequence.","Chemical communications (Cambridge, England)","2021","57","16","2045","2048","10.1039/d0cc08184a","","","0.71073","MoKα","","0.2037","0.0877","","","0.1633","0.2056","","","","","","1.029","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127804","9.9178","0.0002","25.087","0.0005","18.0566","0.0004","90","","99.668","0.001","90","","4428.82","0.16","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H17 Br N2 O3 -","- C28 H17 Br N2 O3 -","- C224 H136 Br8 N16 O24 -","8","2","","Edukondalu, Athukuri; Vagh, Sandip Sambhaji; Lin, Ting-Han; Lin, Wenwei","Construction of indeno[1,2-b]pyrroles via chemoselective N-acylation/cyclization/Wittig reaction sequence.","Chemical communications (Cambridge, England)","2021","57","16","2045","2048","10.1039/d0cc08184a","","","0.71073","MoKα","","0.0465","0.0326","","","0.0822","0.09","","","","","","0.994","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127805","17.544","0.005","16.528","0.004","9.324","0.003","90","","113.87","0.007","90","","2472.4","1.2","200","2","200","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C28 H22 Br Cl N2 O2 -","- C28 H22 Br Cl N2 O2 -","- C112 H88 Br4 Cl4 N8 O8 -","4","1","","Edukondalu, Athukuri; Vagh, Sandip Sambhaji; Lin, Ting-Han; Lin, Wenwei","Construction of indeno[1,2-b]pyrroles via chemoselective N-acylation/cyclization/Wittig reaction sequence.","Chemical communications (Cambridge, England)","2021","57","16","2045","2048","10.1039/d0cc08184a","","","0.71073","MoKα","","0.0751","0.0434","","","0.0899","0.1008","","","","","","0.994","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127806","30.7223","0.001","6.9755","0.0002","27.9045","0.0009","90","","115.528","0.001","90","","5396.2","0.3","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H20 Br Cl N2 O3 -","- C30 H20 Br Cl N2 O3 -","- C240 H160 Br8 Cl8 N16 O24 -","8","1","","Edukondalu, Athukuri; Vagh, Sandip Sambhaji; Lin, Ting-Han; Lin, Wenwei","Construction of indeno[1,2-b]pyrroles via chemoselective N-acylation/cyclization/Wittig reaction sequence.","Chemical communications (Cambridge, England)","2021","57","16","2045","2048","10.1039/d0cc08184a","","","0.71073","MoKα","","0.0909","0.0702","","","0.1844","0.1973","","","","","","0.994","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127807","17.2881","0.0007","16.3136","0.0007","9.3609","0.0004","90","","113.239","0.001","90","","2425.87","0.18","200","2","200","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C28 H23 Br N2 O2 -","- C28 H23 Br N2 O2 -","- C112 H92 Br4 N8 O8 -","4","1","","Edukondalu, Athukuri; Vagh, Sandip Sambhaji; Lin, Ting-Han; Lin, Wenwei","Construction of indeno[1,2-b]pyrroles via chemoselective N-acylation/cyclization/Wittig reaction sequence.","Chemical communications (Cambridge, England)","2021","57","16","2045","2048","10.1039/d0cc08184a","","","0.71073","MoKα","","0.0674","0.0405","","","0.0834","0.0949","","","","","","0.996","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127808","8.3291","0.0007","9.2178","0.0007","16.6899","0.0015","79.558","0.002","87.777","0.003","74.713","0.002","1215.52","0.18","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H19 Br N2 O3 -","- C30 H19 Br N2 O3 -","- C60 H38 Br2 N4 O6 -","2","1","","Edukondalu, Athukuri; Vagh, Sandip Sambhaji; Lin, Ting-Han; Lin, Wenwei","Construction of indeno[1,2-b]pyrroles via chemoselective N-acylation/cyclization/Wittig reaction sequence.","Chemical communications (Cambridge, England)","2021","57","16","2045","2048","10.1039/d0cc08184a","","","0.71073","MoKα","","0.045","0.0378","","","0.0978","0.1037","","","","","","1.001","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127809","10.0157","0.0003","12.5956","0.0004","26.5786","0.0008","90","","91.122","0.001","90","","3352.35","0.18","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H42 Br N2 O2 P -","- C35 H42 Br N2 O2 P -","- C140 H168 Br4 N8 O8 P4 -","4","1","","Edukondalu, Athukuri; Vagh, Sandip Sambhaji; Lin, Ting-Han; Lin, Wenwei","Construction of indeno[1,2-b]pyrroles via chemoselective N-acylation/cyclization/Wittig reaction sequence.","Chemical communications (Cambridge, England)","2021","57","16","2045","2048","10.1039/d0cc08184a","","","0.71073","MoKα","","0.0657","0.0461","","","0.1198","0.1292","","","","","","1.108","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127810","9.7575","0.0013","10.9781","0.0014","12.4931","0.0014","70.686","0.003","73.323","0.003","72.669","0.003","1178.9","0.3","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H23 Br N2 O3 -","- C28 H23 Br N2 O3 -","- C56 H46 Br2 N4 O6 -","2","1","","Edukondalu, Athukuri; Vagh, Sandip Sambhaji; Lin, Ting-Han; Lin, Wenwei","Construction of indeno[1,2-b]pyrroles via chemoselective N-acylation/cyclization/Wittig reaction sequence.","Chemical communications (Cambridge, England)","2021","57","16","2045","2048","10.1039/d0cc08184a","","","0.71073","MoKα","","0.0375","0.0305","","","0.0797","0.0841","","","","","","1.004","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127811","7.0854","0.0002","18.2878","0.0006","19.8064","0.0007","90","","98.989","0.001","90","","2534.92","0.14","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H21 Br N2 O3 -","- C30 H21 Br N2 O3 -","- C120 H84 Br4 N8 O12 -","4","1","","Edukondalu, Athukuri; Vagh, Sandip Sambhaji; Lin, Ting-Han; Lin, Wenwei","Construction of indeno[1,2-b]pyrroles via chemoselective N-acylation/cyclization/Wittig reaction sequence.","Chemical communications (Cambridge, England)","2021","57","16","2045","2048","10.1039/d0cc08184a","","","0.71073","MoKα","","0.051","0.0333","","","0.0703","0.0786","","","","","","1.017","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127812","8.5021","0.0003","18.0429","0.0006","19.2698","0.0007","90","","90","","90","","2956.04","0.18","123","2","123","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C29 H43 I Mg N2 O -","- C29 H43 I Mg N2 O -","- C116 H172 I4 Mg4 N8 O4 -","4","1","","de Bruin-Dickason, Caspar N; Rosengarten, Christopher A.; Deacon, Glen B.; Jones, Cameron","Enantiopure dimagnesium(i) and magnesium(ii) hydride complexes incorporating chiral amidinate or β-diketiminate ligands.","Chemical communications (Cambridge, England)","2021","57","13","1599","1602","10.1039/d0cc07947b","","","0.71073","MoKα","","0.0589","0.0384","","","0.0521","0.0584","","","","","","1.001","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127813","8.395","0.0002","12.081","0.0003","11.1318","0.0002","90","","96.59","0.002","90","","1121.53","0.04","123","2","123","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H34 N2 -","- C25 H34 N2 -","- C50 H68 N4 -","2","1","","de Bruin-Dickason, Caspar N; Rosengarten, Christopher A.; Deacon, Glen B.; Jones, Cameron","Enantiopure dimagnesium(i) and magnesium(ii) hydride complexes incorporating chiral amidinate or β-diketiminate ligands.","Chemical communications (Cambridge, England)","2021","57","13","1599","1602","10.1039/d0cc07947b","","","1.54184","CuKα","","0.0542","0.0496","","","0.1266","0.1308","","","","","","1.044","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127814","14.8055","0.0004","18.0071","0.0004","19.8803","0.0006","90","","90","","90","","5300.2","0.2","123","2","123","2","","","","","","","","4","I 2 2 2","I 2 2","23","","","","- C114 H154 Mg5 N8 -","- C114 H154 Mg5 N8 -","- C228 H308 Mg10 N16 -","2","0.25","","de Bruin-Dickason, Caspar N; Rosengarten, Christopher A.; Deacon, Glen B.; Jones, Cameron","Enantiopure dimagnesium(i) and magnesium(ii) hydride complexes incorporating chiral amidinate or β-diketiminate ligands.","Chemical communications (Cambridge, England)","2021","57","13","1599","1602","10.1039/d0cc07947b","","","0.71073","MoKα","","0.0337","0.0307","","","0.0751","0.0764","","","","","","1.052","","","","has coordinates,has disorder","262486","2021-03-05","01:19:40",""
"7127815","13.2573","0.0008","23.7844","0.0017","14.6312","0.0011","90","","105.348","0.002","90","","4448.9","0.5","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C108 H124 Mg2 N4 O4 -","- C108 H124 Mg2 N4 O4 -","- C216 H248 Mg4 N8 O8 -","2","1","","de Bruin-Dickason, Caspar N; Rosengarten, Christopher A.; Deacon, Glen B.; Jones, Cameron","Enantiopure dimagnesium(i) and magnesium(ii) hydride complexes incorporating chiral amidinate or β-diketiminate ligands.","Chemical communications (Cambridge, England)","2021","57","13","1599","1602","10.1039/d0cc07947b","","","0.71073","MoKα","","0.1724","0.0843","","","0.1762","0.2204","","","","","","0.974","","","","has coordinates,has disorder","262486","2021-03-05","01:19:40",""
"7127816","9.3482","0.0001","11.4823","0.0002","12.0801","0.0002","109.948","0.002","97.683","0.001","99.626","0.001","1175.98","0.04","123","2","123","2","","","","","","","","4","P 1","P 1","1","","","","- C50 H66 Mg2 N4 -","- C50 H66 Mg2 N4 -","- C50 H66 Mg2 N4 -","1","1","","de Bruin-Dickason, Caspar N; Rosengarten, Christopher A.; Deacon, Glen B.; Jones, Cameron","Enantiopure dimagnesium(i) and magnesium(ii) hydride complexes incorporating chiral amidinate or β-diketiminate ligands.","Chemical communications (Cambridge, England)","2021","57","13","1599","1602","10.1039/d0cc07947b","","","0.71073","MoKα","","0.0287","0.0278","","","0.0755","0.076","","","","","","1.029","","","","has coordinates","262486","2021-03-05","01:19:40",""
"7127817","17.043","0.001","10.651","0.0007","20.583","0.0013","90","","96.752","0.002","90","","3710.4","0.4","123","2","123","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C46 H46 N2 -","- C46 H46 N2 -","- C184 H184 N8 -","4","2","","de Bruin-Dickason, Caspar N; Rosengarten, Christopher A.; Deacon, Glen B.; Jones, Cameron","Enantiopure dimagnesium(i) and magnesium(ii) hydride complexes incorporating chiral amidinate or β-diketiminate ligands.","Chemical communications (Cambridge, England)","2021","57","13","1599","1602","10.1039/d0cc07947b","","","0.71073","MoKα","","0.1414","0.0683","","","0.1094","0.1334","","","","","","1.061","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127818","31.063","0.016","11.549","0.006","14.001","0.008","90","","96.663","0.009","90","","4989","5","301","2","301","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C27 H28 N2 O6 -","- C27 H28 N2 O6 -","- C216 H224 N16 O48 -","8","1","","D, Basavaraja; M S, Ajay Krishna; Krishnan, Jagadeesh; C S, Athira; R R, Amrutha; Suresh, Eringathodi; Somappa, Sasidhar B.","Base-enabled access to diastereoselective spirofuran oxindoles and γ-functionalized allenoates.","Chemical communications (Cambridge, England)","2021","57","14","1746","1749","10.1039/d0cc07715a","","","0.71073","MoKα","","0.0758","0.054","","","0.1281","0.1346","","","","","","0.804","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127819","11.1365","0.0003","7.2858","0.0002","19.8596","0.0005","90","","94.708","0.001","90","","1605.94","0.07","177","2","177","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ORGANIC","","","- C16 H16 Cl N O4 -","- C16 H16 Cl N O4 -","- C64 H64 Cl4 N4 O16 -","4","1","","D, Basavaraja; M S, Ajay Krishna; Krishnan, Jagadeesh; C S, Athira; R R, Amrutha; Suresh, Eringathodi; Somappa, Sasidhar B.","Base-enabled access to diastereoselective spirofuran oxindoles and γ-functionalized allenoates.","Chemical communications (Cambridge, England)","2021","57","14","1746","1749","10.1039/d0cc07715a","","","0.71073","MoKα","","0.0769","0.0462","","","0.1172","0.1404","","","","","","1.056","","","","has coordinates","298703","2025-04-03","05:34:20",""
"7127820","10.8944","0.0001","13.3916","0.0001","14.6339","0.0001","113.179","0.001","99.6","0.001","103.856","0.001","1822.23","0.03","150","0.1","150","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C28 H38 Br3 N2 O8 -","- C28 H38 Br3 N2 O8 -","- C56 H76 Br6 N4 O16 -","2","1","","Knight, Brian J.; Tolchin, Zachary A.; Smith, Joel M.","A predictive model for additions to <i>N</i>-alkyl pyridiniums.","Chemical communications (Cambridge, England)","2021","57","21","2693","2696","10.1039/d1cc00056j","","x-ray","1.54184","CuKα","","0.0438","0.0422","","","0.121","0.1226","","","","","","1.028","","","","has coordinates","263660","2021-04-05","14:05:02",""
"7127821","6.5832","0.0002","12.9279","0.0004","19.4223","0.0007","90","","92.067","0.003","90","","1651.9","0.09","180","0.1","180","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H19 B10 N -","- C13 H19 B10 N -","- C52 H76 B40 N4 -","4","1","","Yang, Ziyi; Wu, Yuanbo; Fu, Yatong; Yang, Jianxin; Lu, Jian; Lu, Ju-You","Palladium-catalyzed selective B(3)-H arylation of o-carboranes with arylboronic acids at room temperature.","Chemical communications (Cambridge, England)","2021","57","13","1655","1658","10.1039/d0cc07591d","","x-ray","0.71073","MoKα","","0.0774","0.0631","","","0.1578","0.1673","","","","","","1.02","","","","has coordinates,has disorder","262487","2021-03-05","01:19:50",""
"7127822","10.8652","0.0009","10.6399","0.0009","19.5358","0.0015","90","","100.152","0.003","90","","2223.1","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H32 B10 N -","- C19 H31 B10 N -","- C76 H124 B40 N4 -","4","1","","Yang, Ziyi; Wu, Yuanbo; Fu, Yatong; Yang, Jianxin; Lu, Jian; Lu, Ju-You","Palladium-catalyzed selective B(3)-H arylation of o-carboranes with arylboronic acids at room temperature.","Chemical communications (Cambridge, England)","2021","57","13","1655","1658","10.1039/d0cc07591d","","","0.71073","MoKα","","0.1329","0.0695","","","0.1842","0.2162","","","","","","1.013","","","","has coordinates","262487","2021-03-05","01:19:50",""
"7127823","12.216","0.0005","12.0622","0.0005","14.8049","0.0006","90","","94.702","0.002","90","","2174.19","0.15","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H22 N2 O3 -","- C29 H22 N2 O3 -","- C116 H88 N8 O12 -","4","1","","Gogoi, Kongkona; Bora, Bidisha R.; Borah, Geetika; Sarma, Bipul; Gogoi, Sanjib","Synthesis of quaternary carbon-centered indolo[1,2-<i>a</i>]quinazolinones and indazolo[1,2-<i>a</i>]indazolones <i>via</i> C-H functionalization.","Chemical communications (Cambridge, England)","2021","57","11","1388","1391","10.1039/d0cc07419e","","","0.71073","MoKα","","0.0898","0.0491","","","0.1269","0.162","","","","","","0.865","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127824","10.104","0.006","12.445","0.008","15.461","0.01","90","","100.966","0.008","90","","1909","2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H21 Cl N2 O2 -","- C21 H21 Cl N2 O2 -","- C84 H84 Cl4 N8 O8 -","4","1","","Gogoi, Kongkona; Bora, Bidisha R.; Borah, Geetika; Sarma, Bipul; Gogoi, Sanjib","Synthesis of quaternary carbon-centered indolo[1,2-<i>a</i>]quinazolinones and indazolo[1,2-<i>a</i>]indazolones <i>via</i> C-H functionalization.","Chemical communications (Cambridge, England)","2021","57","11","1388","1391","10.1039/d0cc07419e","","","0.71073","MoKα","","0.1565","0.0702","","","0.1896","0.2315","","","","","","1.138","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127825","8.213","0.01","9.582","0.012","11.527","0.014","90.502","0.013","107.431","0.013","91.458","0.014","865.1","1.8","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H18 N2 O -","- C23 H18 N2 O -","- C46 H36 N4 O2 -","2","1","","Gogoi, Kongkona; Bora, Bidisha R.; Borah, Geetika; Sarma, Bipul; Gogoi, Sanjib","Synthesis of quaternary carbon-centered indolo[1,2-<i>a</i>]quinazolinones and indazolo[1,2-<i>a</i>]indazolones <i>via</i> C-H functionalization.","Chemical communications (Cambridge, England)","2021","57","11","1388","1391","10.1039/d0cc07419e","","","0.71073","MoKα","","0.0759","0.0491","","","0.146","0.1722","","","","","","1.011","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127826","6.8902","0.0004","11.3752","0.0007","12.5546","0.0008","77.459","0.002","83.636","0.002","81.818","0.002","947.48","0.1","296.15","","296.15","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H23 N O4 S -","- C21 H23 N O4 S -","- C42 H46 N2 O8 S2 -","2","1","","Mu, Qiu-Qi; Nie, Yi-Xue; Li, Hang; Bai, Xing-Feng; Liu, Xue-Wei; Xu, Zheng; Xu, Li-Wen","Catalytic asymmetric oxidative carbonylation-induced kinetic resolution of sterically hindered benzylamines to chiral isoindolinones.","Chemical communications (Cambridge, England)","2021","57","14","1778","1781","10.1039/d0cc07218d","","","1.54178","CuKα","","0.0378","0.0369","","","0.1011","0.1019","","","","","","1.047","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127827","16.7467","0.0004","21.6002","0.0005","7.8088","0.0002","90","","90","","90","","2824.69","0.12","293","2","293","2","","","","","","","","3","A e a 2","A 2 -2ab","41","","","","- C19 H15 N -","- C19 H15 N -","- C152 H120 N8 -","8","1","","Qi, Zhi-Chao; Lou, Qin-Xin; Niu, Yuan; Yang, Shang-Dong","Temporary (P[double bond, length as m-dash]O) directing group enabled carbazole ortho arylation via palladium catalysis.","Chemical communications (Cambridge, England)","2021","57","16","2021","2024","10.1039/d0cc07596e","","x-ray","1.54184","CuKα","","0.0397","0.0379","","","0.0979","0.1007","","","","","","1.041","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127828","8.337","0.008","8.954","0.009","10.867","0.011","109.95","0.01","102.666","0.011","98.075","0.006","723.2","1.2","143","","143","","","","","","","","","6","P -1","-P 1","2","","","","- C15 H16 B Cl F2 N2 -","- C15 H16 B Cl F2 N2 -","- C30 H32 B2 Cl2 F4 N4 -","2","1","","Mu, Huiying; Miki, Koji; Kubo, Takuya; Otsuka, Koji; Ohe, Kouichi","Substituted <i>meso</i>-vinyl-BODIPY as thiol-selective fluorogenic probes for sensing unfolded proteins in the endoplasmic reticulum.","Chemical communications (Cambridge, England)","2021","57","14","1818","1821","10.1039/d0cc08160d","","","0.71075","MoKα","","","0.041","","","","0.0785","","","","","","1","","","","has coordinates","262496","2021-03-05","01:21:25",""
"7127829","10.7823","0.0003","11.0287","0.0003","15.3429","0.0004","107.822","0.004","91.112","0.003","107.275","0.003","1646.34","0.09","100","2","100","2","","","","","","","synthesis as described","5","P 1","P 1","1","Au(D-bordt)(OC4)","Gold(D-bornylene-1,2-dithiolate)(1,2-bis(4-butoxyphenyl)ethylene-dithiolate)","","- C32 H40 Au O2 S4 -","- C32 H40 Au O2 S4 -","- C64 H80 Au2 O4 S8 -","2","2","","Perochon, Romain; Barrière, Frédéric; Jeannin, Olivier; Piekara-Sady, Lidia; Fourmigué, Marc","A radical mixed-ligand gold bis(dithiolene) complex.","Chemical communications (Cambridge, England)","2021","57","13","1615","1618","10.1039/d0cc07602c","","x-ray","0.71073","MoKα","","0.0358","0.0301","","","0.0683","0.0713","","","","","","1.021","","","","has coordinates","262490","2021-03-05","01:20:17",""
"7127830","20.5184","0.0011","20.5184","0.0011","13.0844","0.0007","90","","90","","120","","4770.6","0.4","100","","100.15","","","","","","","","","6","P 62","P 62","171","","","","- C68.22 H58.66 Cl3.78 N4 O0.74 Pd2 -","- C68.274 H58.822 Cl3.726 N4 O0.758 Pd2 -","- C204.822 H176.466 Cl11.178 N12 O2.274 Pd6 -","3","0.5","","Lin, Jinqiang; Xie, Mo; Zhang, Xiaobao; Gao, Qin; Chang, Xiaoyong; Zou, Chao; Lu, Wei","Helically chiral Pd(ii) complexes containing intramolecular PdPd metallophilicity as circularly polarized molecular phosphors.","Chemical communications (Cambridge, England)","2021","57","13","1627","1630","10.1039/d0cc08188d","","x-ray","0.71073","MoKα","","0.0923","0.0818","","","0.212","0.2207","","","","","","1.09","","","","has coordinates,has disorder","262488","2021-03-05","01:20:01",""
"7127831","20.5118","0.0014","20.5118","0.0014","13.0966","0.001","90","","90","","120","","4772","0.6","100","","100","","","","","","","","","6","P 31","P 31","144","","","","- C68.02 H58.06 Cl3.98 N4 O0.67 Pd2 -","- C68.01 H58.03 Cl3.99 N4 O0.67 Pd2 -","- C204.03 H174.09 Cl11.97 N12 O2.01 Pd6 -","3","1","","Lin, Jinqiang; Xie, Mo; Zhang, Xiaobao; Gao, Qin; Chang, Xiaoyong; Zou, Chao; Lu, Wei","Helically chiral Pd(ii) complexes containing intramolecular PdPd metallophilicity as circularly polarized molecular phosphors.","Chemical communications (Cambridge, England)","2021","57","13","1627","1630","10.1039/d0cc08188d","","x-ray","0.71073","MoKα","","0.0697","0.0591","","","0.148","0.1554","","","","","","1.047","","","","has coordinates,has disorder","262488","2021-03-05","01:20:01",""
"7127832","8.0048","0.0003","11.7155","0.0005","13.6559","0.0005","90","","92.414","0.003","90","","1279.52","0.09","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C29 H22 Cl N O2 S2 -","- C29 H22 Cl N O2 S2 -","- C58 H44 Cl2 N2 O4 S4 -","2","1","","Tian, Jun; Yuan, Kang-Ning; Liu, Wen; Chang, Hong-Hong; Li, Xing; Gao, Wen-Chao","3-Thiolated pyrroles/pyrrolines: controllable synthesis and usage for the construction of thiolated fluorophores.","Chemical communications (Cambridge, England)","2021","57","15","1943","1946","10.1039/d0cc07988j","","x-ray","1.54184","CuKα","","0.0337","0.0324","","","0.088","0.0896","","","","","","1.034","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127833","9.9298","0.0007","11.0745","0.0007","13.1127","0.0009","70.55","0.002","77.681","0.002","76.72","0.002","1308.52","0.15","298","2","298.1","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H27 N O2 S2 -","- C30 H27 N O2 S2 -","- C60 H54 N2 O4 S4 -","2","1","","Tian, Jun; Yuan, Kang-Ning; Liu, Wen; Chang, Hong-Hong; Li, Xing; Gao, Wen-Chao","3-Thiolated pyrroles/pyrrolines: controllable synthesis and usage for the construction of thiolated fluorophores.","Chemical communications (Cambridge, England)","2021","57","15","1943","1946","10.1039/d0cc07988j","","","0.71073","MoKα","","0.0813","0.0654","","","0.1336","0.1486","","","","","","1.103","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127834","11.971","0.0007","34.5822","0.0018","12.0112","0.0006","90","","97.196","0.002","90","","4933.3","0.5","100","","100","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H46 B2 F8 N8 O2 Rh2 -","- C52 H46 B2 F8 N8 O2 Rh2 -","- C208 H184 B8 F32 N32 O8 Rh8 -","4","1","","Manamperi, Hemanthi D.; Moore, Curtis E.; Turro, Claudia","Dirhodium complexes as electrocatalysts for CO<sub>2</sub> reduction to HCOOH: role of steric hindrance on selectivity.","Chemical communications (Cambridge, England)","2021","57","13","1635","1638","10.1039/d0cc07659g","","x-ray","0.71073","MoKα","","0.0577","0.0421","","","0.0756","0.0801","","","","","","1.082","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127835","22.1265","0.0005","20.9437","0.0005","24.5322","0.0006","90","","90","","90","","11368.5","0.5","100","","100","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C62 H63 B2 F8 N9 O Rh2 -","- C62 H63 B2 F8 N9 O Rh2 -","- C496 H504 B16 F64 N72 O8 Rh16 -","8","1","","Manamperi, Hemanthi D.; Moore, Curtis E.; Turro, Claudia","Dirhodium complexes as electrocatalysts for CO<sub>2</sub> reduction to HCOOH: role of steric hindrance on selectivity.","Chemical communications (Cambridge, England)","2021","57","13","1635","1638","10.1039/d0cc07659g","","x-ray","0.71073","MoKα","K-L~3~","0.08","0.0472","","","0.0994","0.1145","","","","","","1.06","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127836","9.927","0.002","14.803","0.003","19.257","0.004","86.172","0.003","89.944","0.003","88.535","0.003","2822.6","1","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H75 N O14 S -","- C62 H75 N O14 S -","- C124 H150 N2 O28 S2 -","2","1","","Iwamoto, Hajime; Ishizu, Yuki; Hasegawa, Eietsu; Sekiya, Ryo; Haino, Takeharu","Translational isomers of <i>N</i>-sulfonylated [3]catenane: synthesis and isomerization.","Chemical communications (Cambridge, England)","2021","57","15","1915","1918","10.1039/d0cc07720h","","","0.71073","MoKα","","0.0919","0.0522","","","0.1198","0.1397","","","","","","1.02","","","","has coordinates","262502","2021-03-05","01:22:17",""
"7127837","14.1096","0.0006","38.074","0.0016","9.9404","0.0004","90","","93.283","0.001","90","","5331.3","0.4","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C112 H146 N2 O28 S2 -","- C112 H146 N2 O28 S2 -","- C224 H292 N4 O56 S4 -","2","0.5","","Iwamoto, Hajime; Ishizu, Yuki; Hasegawa, Eietsu; Sekiya, Ryo; Haino, Takeharu","Translational isomers of <i>N</i>-sulfonylated [3]catenane: synthesis and isomerization.","Chemical communications (Cambridge, England)","2021","57","15","1915","1918","10.1039/d0cc07720h","","","0.71073","MoKα","","0.0691","0.0416","","","0.0895","0.101","","","","","","1.027","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127838","11.663","0.012","12.52","0.013","21.3","0.02","78.986","0.013","76.432","0.015","85.801","0.012","2966","5","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C126 H158 N2 O28 S2 -","- C126 H158 N2 O28 S2 -","- C126 H158 N2 O28 S2 -","1","0.5","","Iwamoto, Hajime; Ishizu, Yuki; Hasegawa, Eietsu; Sekiya, Ryo; Haino, Takeharu","Translational isomers of <i>N</i>-sulfonylated [3]catenane: synthesis and isomerization.","Chemical communications (Cambridge, England)","2021","57","15","1915","1918","10.1039/d0cc07720h","","","0.71073","MoKα","","0.1415","0.1075","","","0.2958","0.3341","","","","","","1.451","","","","has coordinates","262502","2021-03-05","01:22:17",""
"7127839","8.094","0.0003","17.4703","0.0008","11.2484","0.0005","90","","99.299","0.004","90","","1569.67","0.12","298","","298","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H15 N O2 -","- C20 H15 N O2 -","- C80 H60 N4 O8 -","4","2","","Lai, Xiaojing; Liu, Jin-Biao; Wang, Yu-Chao; Qiu, Guanyinsheng","Iron-catalyzed intramolecular acyl nitrene/alkyne metalation for the synthesis of pyrrolo[2,1-a]isoindol-5-ones.","Chemical communications (Cambridge, England)","2021","57","16","2077","2080","10.1039/d0cc08039j","","x-ray","1.54184","CuKα","","0.0514","0.0461","","","0.1162","0.124","","","","","","1.053","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127840","6.7666","0.0006","8.5442","0.0005","16.8887","0.0012","98.888","0.005","91.797","0.006","103.272","0.006","936.66","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H17 N O2 -","- C25 H17 N O2 -","- C50 H34 N2 O4 -","2","1","","Lai, Xiaojing; Liu, Jin-Biao; Wang, Yu-Chao; Qiu, Guanyinsheng","Iron-catalyzed intramolecular acyl nitrene/alkyne metalation for the synthesis of pyrrolo[2,1-a]isoindol-5-ones.","Chemical communications (Cambridge, England)","2021","57","16","2077","2080","10.1039/d0cc08039j","","x-ray","1.54184","CuKα","","0.0605","0.0554","","","0.1428","0.1512","","","","","","0.905","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127841","15.7986","0.0002","15.3979","0.0001","16.0085","0.0003","90","","119.177","0.002","90","","3400.19","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H90 Al10 O40 -","- C40 H90 Al10 O40 -","- C80 H180 Al20 O80 -","2","0.5","","Geng, Lin; Li, Qiao-Hong; Wang, San-Tai; Liu, Ya-Jie; Fang, Wei-Hui; Zhang, Jian","Aluminium nanorings: configuration deformation and structural transformation.","Chemical communications (Cambridge, England)","2021","57","16","2085","2088","10.1039/d0cc07513b","","","1.3405","GaKα","","0.0673","0.0623","","","0.1612","0.1646","","","","","","1.106","","","","has coordinates,has disorder","262482","2021-03-05","01:18:47",""
"7127842","20.7362","0.0005","25.0136","0.0005","38.8351","0.0013","90","","90","","90","","20143.3","0.9","297.27","0.1","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C52 H84 Al10 F0.12 O50 -","- C52 H84 Al10 F2 O48 -","- C416 H672 Al80 F16 O384 -","8","0.25","","Geng, Lin; Li, Qiao-Hong; Wang, San-Tai; Liu, Ya-Jie; Fang, Wei-Hui; Zhang, Jian","Aluminium nanorings: configuration deformation and structural transformation.","Chemical communications (Cambridge, England)","2021","57","16","2085","2088","10.1039/d0cc07513b","","","1.3405","GaKα","","0.0384","0.0358","","","0.1097","0.1121","","","","","","1.05","","","","has coordinates","262482","2021-03-05","01:18:47",""
"7127843","19.8191","0.0006","16.1753","0.0004","15.5044","0.0005","90","","111.372","0.004","90","","4628.6","0.3","101.2","0.7","101.2","0.7","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C56 H92 Al10 F0.5 O50 -","- C56 H92 Al10 F2 O48 -","- C112 H184 Al20 F4 O96 -","2","0.5","","Geng, Lin; Li, Qiao-Hong; Wang, San-Tai; Liu, Ya-Jie; Fang, Wei-Hui; Zhang, Jian","Aluminium nanorings: configuration deformation and structural transformation.","Chemical communications (Cambridge, England)","2021","57","16","2085","2088","10.1039/d0cc07513b","","","1.3405","GaKα","","0.0472","0.0433","","","0.1124","0.1143","","","","","","1.004","","","","has coordinates","262482","2021-03-05","01:18:47",""
"7127844","20.1093","0.0005","27.0496","0.0006","7.7076","0.0002","90","","115.686","0.003","90","","3778.24","0.19","107.3","0.3","107.3","0.3","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C50 H110 Al10 O40 -","- C50 H110 Al10 O40 -","- C100 H220 Al20 O80 -","2","0.25","","Geng, Lin; Li, Qiao-Hong; Wang, San-Tai; Liu, Ya-Jie; Fang, Wei-Hui; Zhang, Jian","Aluminium nanorings: configuration deformation and structural transformation.","Chemical communications (Cambridge, England)","2021","57","16","2085","2088","10.1039/d0cc07513b","","x-ray","1.3405","GaKα","","0.0686","0.0599","","","0.1605","0.1692","","","","","","1.114","","","","has coordinates,has disorder","262482","2021-03-05","01:18:47",""
"7127845","8.6547","0.0001","44.2025","0.0006","28.0556","0.0004","90","","107.322","0.001","90","","10246.2","0.2","120.01","0.1","120.01","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H90 Al10 O40 -","- C39.6667 H89 Al10 O40 -","- C238 H534 Al60 O240 -","6","1.5","","Geng, Lin; Li, Qiao-Hong; Wang, San-Tai; Liu, Ya-Jie; Fang, Wei-Hui; Zhang, Jian","Aluminium nanorings: configuration deformation and structural transformation.","Chemical communications (Cambridge, England)","2021","57","16","2085","2088","10.1039/d0cc07513b","","","1.3405","GaKα","","0.0657","0.0586","","","0.1437","0.147","","","","","","1.151","","","","has coordinates,has disorder","262482","2021-03-05","01:18:47",""
"7127846","15.53","0.0004","17.7065","0.0004","16.3216","0.0005","90","","90","","90","","4488.1","0.2","100","0.11","100","0.11","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C48 H76 Al10 F2 O48 -","- C48 H76 Al10 F2 O48 -","- C96 H152 Al20 F4 O96 -","2","0.5","","Geng, Lin; Li, Qiao-Hong; Wang, San-Tai; Liu, Ya-Jie; Fang, Wei-Hui; Zhang, Jian","Aluminium nanorings: configuration deformation and structural transformation.","Chemical communications (Cambridge, England)","2021","57","16","2085","2088","10.1039/d0cc07513b","","","1.54184","CuKα","","0.0462","0.0374","","","0.091","0.097","","","","","","1.043","","","","has coordinates","262482","2021-03-05","01:18:47",""
"7127847","9.1044","0.0002","15.8179","0.0002","28.5609","0.0003","90","","91.622","0.001","90","","4111.48","0.11","100.6","0.8","100.6","0.8","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C60 H130 Al10 O40 -","- C60 H130 Al10 O40 -","- C120 H260 Al20 O80 -","2","0.5","","Geng, Lin; Li, Qiao-Hong; Wang, San-Tai; Liu, Ya-Jie; Fang, Wei-Hui; Zhang, Jian","Aluminium nanorings: configuration deformation and structural transformation.","Chemical communications (Cambridge, England)","2021","57","16","2085","2088","10.1039/d0cc07513b","","x-ray","1.3405","GaKα","","0.0843","0.0652","","","0.1787","0.1945","","","","","","1.029","","","","has coordinates,has disorder","262482","2021-03-05","01:18:47",""
"7127848","9.0356","0.0003","26.9308","0.0009","17.7744","0.0005","90","","101.73","0.001","90","","4234.8","0.2","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H55 N Ni P2 -","- C41 H55 N Ni P2 -","- C164 H220 N4 Ni4 P8 -","4","1","","Wu, Ke; Ling, Yichen; Sun, Nan; Hu, Baoxiang; Shen, Zhenlu; Jin, Liqun; Hu, Xinquan","Ni-catalyzed reductive decyanation of nitriles with ethanol as the reductant.","Chemical communications (Cambridge, England)","2021","57","18","2273","2276","10.1039/d0cc07743g","","","0.71073","MoKα","","0.0868","0.0543","","","0.1524","0.1728","","","","","","1.029","","","","has coordinates","262506","2021-03-05","01:22:56",""
"7127849","10.8408","0.0006","26.2799","0.0013","11.5932","0.0005","90","","117.247","0.003","90","","2936.4","0.3","100","","100.1","","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C48 H66 Cl3 F12 Gd N8 O11 -","- C48 H64 Cl3 F12 Gd N8 O11 -","- C96 H128 Cl6 F24 Gd2 N16 O22 -","2","0.5","","Subasinghe, S A Amali S; Romero, Jonathan; Ward, Cassandra L.; Bailey, Matthew D.; Zehner, Donna R.; Mehta, Prakrut J.; Carniato, Fabio; Botta, Mauro; Yustein, Jason T.; Pautler, Robia G.; Allen, Matthew J.","Magnetic resonance thermometry using a Gd<sup>III</sup>-based contrast agent.","Chemical communications (Cambridge, England)","2021","57","14","1770","1773","10.1039/d0cc06400a","","","0.71073","MoKα","","0.145","0.1","","","0.2465","0.2788","","","","","","1.026","","","","has coordinates,has disorder","262499","2021-03-05","01:21:48",""
"7127850","15.2967","0.0007","11.2692","0.0005","15.7712","0.0007","90","","90.312","0.002","90","","2718.6","0.2","100","","100","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C48 H70 Gd I3 N8 O7 -","- C48 H70 Gd I3 N8 O7 -","- C96 H140 Gd2 I6 N16 O14 -","2","1","","Subasinghe, S A Amali S; Romero, Jonathan; Ward, Cassandra L.; Bailey, Matthew D.; Zehner, Donna R.; Mehta, Prakrut J.; Carniato, Fabio; Botta, Mauro; Yustein, Jason T.; Pautler, Robia G.; Allen, Matthew J.","Magnetic resonance thermometry using a Gd<sup>III</sup>-based contrast agent.","Chemical communications (Cambridge, England)","2021","57","14","1770","1773","10.1039/d0cc06400a","","","0.71073","MoKα","","0.0576","0.0397","","","0.0674","0.0729","","","","","","1.034","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127851","16.1425","0.0009","16.4681","0.0009","12.6844","0.0007","90","","93.264","0.002","90","","3366.5","0.3","150","","150","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C36 H58 Au2 Cl8 N24 O26 -","- C36 H58 Au2 Cl8 N24 O26 -","- C72 H116 Au4 Cl16 N48 O52 -","2","0.25","","Song, Xianmeng; Cao, Minna; Chen, Ruru; Wang, Huimin; Li, Hongfang; Cao, Rong","Enhanced selectivity and stability towards CO<sub>2</sub> reduction of sub-5 nm Au NPs derived from supramolecular assembly.","Chemical communications (Cambridge, England)","2021","57","20","2491","2494","10.1039/d0cc08353d","","","1.54178","CuKα","","0.0244","0.0243","","","0.063","0.063","","","","","","1.121","","","","has coordinates","263644","2021-04-05","14:01:30",""
"7127852","29.299","0.0012","29.299","0.0012","26.3901","0.0014","90","","90","","120","","19619","1.5","185","2","185.31","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C H Au Cl N O -","- C2.57143 H3.46428 Au0.107143 Cl0.428571 N1.71429 O1.32143 -","- C432 H581.999 Au18 Cl72 N288 O222 -","168","9.33333","","Song, Xianmeng; Cao, Minna; Chen, Ruru; Wang, Huimin; Li, Hongfang; Cao, Rong","Enhanced selectivity and stability towards CO<sub>2</sub> reduction of sub-5 nm Au NPs derived from supramolecular assembly.","Chemical communications (Cambridge, England)","2021","57","20","2491","2494","10.1039/d0cc08353d","","","0.71073","MoKα","","0.0676","0.0453","","","0.1157","0.1268","","","","","","1.026","","","","has coordinates","263644","2021-04-05","14:01:30",""
"7127853","12.8815","0.0003","14.9476","0.0004","26.9853","0.0007","90","","90","","90","","5196","0.2","300","2","299.68","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C40 H56 Au Cl4 N20 O13 -","- C40 H56 Au Cl4 N20 O13 -","- C160 H224 Au4 Cl16 N80 O52 -","4","0.5","","Song, Xianmeng; Cao, Minna; Chen, Ruru; Wang, Huimin; Li, Hongfang; Cao, Rong","Enhanced selectivity and stability towards CO<sub>2</sub> reduction of sub-5 nm Au NPs derived from supramolecular assembly.","Chemical communications (Cambridge, England)","2021","57","20","2491","2494","10.1039/d0cc08353d","","","0.71073","MoKα","","0.0613","0.0447","","","0.137","0.1509","","","","","","1.044","","","","has coordinates","263644","2021-04-05","14:01:30",""
"7127854","7.7964","0.0003","10.0946","0.0004","14.0983","0.0006","88.048","0.001","79.545","0.001","76.425","0.001","1060.61","0.07","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H18 N4 O4 Zn -","- C26 H18 N4 O4 Zn -","- C52 H36 N8 O8 Zn2 -","2","1","","Song, Wei-Chao; Geng, Chen-Chen; Li, Sheng-Yang; Liang, Ling; Wang, Xiu-Guang; Yang, En-Cui; Zhao, Xiao-Jun","Photo-oligomerization by shifting the coordination site in a luminescent coordination polymer.","Chemical communications (Cambridge, England)","2021","57","17","2148","2151","10.1039/d0cc08021g","","","0.71073","MoKα","","0.0289","0.0266","","","0.0687","0.0699","","","","","","1.055","","","","has coordinates","262477","2021-03-05","01:17:31",""
"7127855","8.219","0.0004","10.0622","0.0005","13.9221","0.0007","89.079","0.004","76.966","0.004","76.522","0.004","1090.01","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H18 N4 O4 Zn -","- C26 H18 N4 O4 Zn -","- C52 H36 N8 O8 Zn2 -","2","1","","Song, Wei-Chao; Geng, Chen-Chen; Li, Sheng-Yang; Liang, Ling; Wang, Xiu-Guang; Yang, En-Cui; Zhao, Xiao-Jun","Photo-oligomerization by shifting the coordination site in a luminescent coordination polymer.","Chemical communications (Cambridge, England)","2021","57","17","2148","2151","10.1039/d0cc08021g","","x-ray","1.54184","CuKα","","0.0969","0.0698","","","0.1695","0.1879","","","","","","1.035","","","","has coordinates,has disorder","262477","2021-03-05","01:17:31",""
"7127856","10.0919","0.0002","14.4515","0.0002","40.1739","0.0006","90","","92.765","0.001","90","","5852.26","0.17","123","1","123","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H72 F12 Fe2 O4 P6 Ru -","- C48 H72 F12 Fe2 O4 P6 Ru -","- C192 H288 F48 Fe8 O16 P24 Ru4 -","4","1","","Müller, Julian; Balázs, Gábor; Scheer, Manfred","From a P<sub>4</sub> butterfly scaffold to <i>cyclo</i>- and <i>catena</i>-P<sub>4</sub> units.","Chemical communications (Cambridge, England)","2021","57","18","2257","2260","10.1039/d0cc08328c","","x-ray","0.71073","MoKα","","0.0481","0.0386","","","0.088","0.0924","","","","","","1.079","","","","has coordinates,has disorder","262507","2021-03-05","01:23:14",""
"7127857","12.9624","0.0004","14.8814","0.0004","18.4164","0.0004","73.521","0.002","72.266","0.003","80.18","0.002","3230.9","0.16","123","1","123","1","","","","","","","","8","P -1","-P 1","2","","","","- C50 H77 Cl4 F12 Fe2 O4 P6 Rh -","- C50 H77 Cl4 F12 Fe2 O4 P6 Rh -","- C100 H154 Cl8 F24 Fe4 O8 P12 Rh2 -","2","1","","Müller, Julian; Balázs, Gábor; Scheer, Manfred","From a P<sub>4</sub> butterfly scaffold to <i>cyclo</i>- and <i>catena</i>-P<sub>4</sub> units.","Chemical communications (Cambridge, England)","2021","57","18","2257","2260","10.1039/d0cc08328c","","x-ray","1.54184","CuKα","","0.0328","0.0283","","","0.0648","0.0671","","","","","","1.015","","","","has coordinates,has disorder","262507","2021-03-05","01:23:14",""
"7127858","18.66252","0.0002","16.39571","0.00014","20.2876","0.0003","90","","104.548","0.0011","90","","6008.67","0.12","123.01","0.13","123.01","0.13","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C49.8 H78.6 F6 Fe2 O3.7 P5 Ru -","- C49.8 H78.6 F6 Fe2 O3.7 P5 Ru -","- C199.2 H314.4 F24 Fe8 O14.8 P20 Ru4 -","4","1","","Müller, Julian; Balázs, Gábor; Scheer, Manfred","From a P<sub>4</sub> butterfly scaffold to <i>cyclo</i>- and <i>catena</i>-P<sub>4</sub> units.","Chemical communications (Cambridge, England)","2021","57","18","2257","2260","10.1039/d0cc08328c","","x-ray","1.54184","CuKα","","0.0349","0.0332","","","0.0873","0.0887","","","","","","1.042","","","","has coordinates","262507","2021-03-05","01:23:14",""
"7127859","12.9537","0.0002","14.8742","0.0002","18.4134","0.0002","73.489","0.001","72.346","0.001","80.07","0.001","3226.85","0.08","123","1","123","1","","","","","","","","8","P -1","-P 1","2","","","","- C50 H77 Cl4 F12 Fe2 Ir O4 P6 -","- C50 H77 Cl4 F12 Fe2 Ir O4 P6 -","- C100 H154 Cl8 F24 Fe4 Ir2 O8 P12 -","2","1","","Müller, Julian; Balázs, Gábor; Scheer, Manfred","From a P<sub>4</sub> butterfly scaffold to <i>cyclo</i>- and <i>catena</i>-P<sub>4</sub> units.","Chemical communications (Cambridge, England)","2021","57","18","2257","2260","10.1039/d0cc08328c","","x-ray","0.71073","MoKα","","0.0267","0.0222","","","0.0503","0.0519","","","","","","1.028","","","","has coordinates,has disorder","262507","2021-03-05","01:23:14",""
"7127860","12.614","0.002","27.595","0.004","15.86","0.005","90","","113.041","0.013","90","","5080","2","190","2","190","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Shi_Ir2","","","- C44 H35 Cl10 F6 Ir N11 P -","- C44 H35 Cl10 F6 Ir N11 P -","- C176 H140 Cl40 F24 Ir4 N44 P4 -","4","1","","Liu, Xin; Li, Kun; Shi, Lei; Zhang, Hong; Liu, Yan-Hong; Wang, Hao-Yuan; Wang, Nan; Yu, Xiao-Qi","Purine-based Ir(iii) complexes for sensing viscosity of endo-plasmic reticulum with fluorescence lifetime imaging microscopy.","Chemical communications (Cambridge, England)","2021","57","18","2265","2268","10.1039/d0cc07867k","","","1.54184","CuKα","","0.0424","0.0348","","","0.0884","0.0921","","","","","","1.04","","","","has coordinates","262509","2021-03-05","01:23:30",""
"7127861","6.9944","0.0005","11.3189","0.0005","14.3507","0.0007","90","","98.083","0.005","90","","1124.84","0.11","297.5","0.2","297.5","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H9 Cl N4 -","- C12 H9 Cl N4 -","- C48 H36 Cl4 N16 -","4","1","","Liu, Xin; Li, Kun; Shi, Lei; Zhang, Hong; Liu, Yan-Hong; Wang, Hao-Yuan; Wang, Nan; Yu, Xiao-Qi","Purine-based Ir(iii) complexes for sensing viscosity of endo-plasmic reticulum with fluorescence lifetime imaging microscopy.","Chemical communications (Cambridge, England)","2021","57","18","2265","2268","10.1039/d0cc07867k","","x-ray","1.54184","CuKα","","0.0784","0.0716","","","0.1887","0.1996","","","","","","1.085","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127862","29.422","0.0004","29.422","0.0004","40.288","0.0009","90","","90","","90","","34875.5","1","103","4","103","4","","","","","","","","7","I 4/m","-I 4","87","","ImBDC-Co","","- C390 H354 Co24 I0.42 N24 O126 S24 -","- C390 H356.4 Co24 I0.42 N24 O126 S24 -","- C780 H712.8 Co48 I0.84 N48 O252 S48 -","2","0.125","","Tong, Hui-Ying; Liang, Jun; Wu, Qiu-Jin; Zou, Yu-Huang; Huang, Yuan-Biao; Cao, Rong","Soluble imidazolium-functionalized coordination cages for efficient homogeneous catalysis of CO<sub>2</sub> cycloaddition reactions.","Chemical communications (Cambridge, England)","2021","57","17","2140","2143","10.1039/d0cc08098e","","x-ray","1.3405","GaKα","","0.1105","0.0875","","","0.2801","0.2982","","","","","","1.154","","","","has coordinates,has disorder","262476","2021-03-05","01:17:24",""
"7127863","29.1997","0.0005","29.1997","0.0005","40.4454","0.0012","90","","90","","90","","34484.7","1.3","293","","293","","","","","","","","","7","I 4/m","-I 4","87","","","","- C390 H343.33 I2.28 N24 Ni24 O126 S24 -","- C390 H347.32 I2.275 N24 Ni24 O126 S24 -","- C780 H694.64 I4.55 N48 Ni48 O252 S48 -","2","0.125","","Tong, Hui-Ying; Liang, Jun; Wu, Qiu-Jin; Zou, Yu-Huang; Huang, Yuan-Biao; Cao, Rong","Soluble imidazolium-functionalized coordination cages for efficient homogeneous catalysis of CO<sub>2</sub> cycloaddition reactions.","Chemical communications (Cambridge, England)","2021","57","17","2140","2143","10.1039/d0cc08098e","","","1.3405","GaKα","","0.1524","0.1121","","","0.3317","0.3583","","","","","","1.325","","","","has coordinates,has disorder","262476","2021-03-05","01:17:24",""
"7127864","10.949","0.0012","19.966","0.002","7.4024","0.0008","90","","99.422","0.001","90","","1596.4","0.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H14 B N O2 -","- C24 H14 B N O2 -","- C96 H56 B4 N4 O8 -","4","0.5","","Kitamoto, Y.; Oda, K.; Ogino, K.; Hiyama, K.; Kita, H.; Hattori, T.; Oi, S.","Synthesis of an azadioxa-planar triphenylborane and investigation of its structural and photophysical properties.","Chemical communications (Cambridge, England)","2021","57","18","2297","2300","10.1039/d0cc08331c","","","0.71073","MoKα","","0.0445","0.0407","","","0.1214","0.1255","","","","","","1.045","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127865","27.567","0.004","28.542","0.004","31.98","0.005","68.697","0.004","66.104","0.004","90.004","0.004","21111","5","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C190 H151 Au23 N4 O4 P9 S4 -","- C190 H151 Au23 N4 O4 P9 S4 -","- C760 H604 Au92 N16 O16 P36 S16 -","4","2","","Li, Shuohao; Sun, Yongnan; Wu, Chenyang; Hu, Weigang; Li, Wei; Liu, Xu; Chen, Mingyang; Zhu, Yan","Distinct structure assembly driven by metal-ligand binding in Au<sub>23</sub> nanoclusters and its relation to photocatalysis.","Chemical communications (Cambridge, England)","2021","57","17","2176","2179","10.1039/d0cc08327e","","","0.71073","MoKα","","0.2035","0.0898","","","0.2216","0.2451","","","","","","1.192","","","","has coordinates","262475","2021-03-05","01:17:00",""
"7127866","12.2758","0.0005","10.2771","0.0004","7.5324","0.0003","90","","104.454","0.001","90","","920.21","0.06","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C4 H2 Cd N2 O2 -","- C4 H2 Cd N2 O2 -","- C32 H16 Cd8 N16 O16 -","8","1","","Zhu, Liwei; Liu, Ning; Lv, Xincheng; Zhang, Ziqiu; Yu, Liangmin; Li, Xia","A novel metal-organic framework derived carbon nanoflower with effective electromagnetic microwave absorption and high-performance electrochemical energy storage properties.","Chemical communications (Cambridge, England)","2021","57","20","2539","2542","10.1039/d1cc00253h","","","0.71073","MoKα","","0.0176","0.0153","","","0.0362","0.0371","","","","","","1.114","","","","has coordinates","263649","2021-04-05","14:02:07",""
"7127867","27.51","0.002","5.7053","0.0005","10.3731","0.0009","90","","95.37","0.002","90","","1620.9","0.2","293","2","273.15","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C19 H21 N O2 -","- C19 H21 N O2 -","- C76 H84 N4 O8 -","4","1","","Xie, Yi-Wen; Zhao, Zhen-Ni; Lin, Zi-Wei; Wang, Yu-Hao; Liu, Ya-Qun; Huang, Yi-Yong","Asymmetric Petasis reaction for the synthesis of chiral α- and β-butadienyl amines.","Chemical communications (Cambridge, England)","2021","57","19","2364","2367","10.1039/d0cc08241d","","","0.71073","MoKα","","0.0402","0.0373","","","0.1025","0.105","","","","","","1.033","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127868","30.0312","0.0002","24.2172","0.0002","33.2627","0.0002","90","","95.4521","0.0006","90","","24081.6","0.3","100","0.1","100","0.1","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C398 H340 Ag50 F36 N8 O4 P12 S43 -","- C398 H340 Ag50 F36 N8 O4 P12 S43 -","- C796 H680 Ag100 F72 N16 O8 P24 S86 -","2","0.5","","Sun, Qiao-Qiao; Li, Qian; Li, Hai-Yang; Zhang, Miao-Miao; Sun, Meng-En; Li, Si; Quan, Zewei; Zang, Shuang-Quan","Thermochromism and piezochromism of an atomically precise high-nuclearity silver sulfide nanocluster.","Chemical communications (Cambridge, England)","2021","57","19","2372","2375","10.1039/d0cc07085h","","x-ray","1.54184","CuKα","","0.0952","0.0867","","","0.2486","0.2581","","","","","","1.084","","","","has coordinates,has disorder","263638","2021-04-05","13:59:46",""
"7127869","30.0586","0.0002","24.3044","0.0002","33.3509","0.0002","90","","95.349","0.001","90","","24258.6","0.3","150","0.1","150","0.1","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C398 H340 Ag50 F36 N8 O4 P12 S43 -","- C398 H340 Ag50 F36 N8 O4 P12 S43 -","- C796 H680 Ag100 F72 N16 O8 P24 S86 -","2","0.5","","Sun, Qiao-Qiao; Li, Qian; Li, Hai-Yang; Zhang, Miao-Miao; Sun, Meng-En; Li, Si; Quan, Zewei; Zang, Shuang-Quan","Thermochromism and piezochromism of an atomically precise high-nuclearity silver sulfide nanocluster.","Chemical communications (Cambridge, England)","2021","57","19","2372","2375","10.1039/d0cc07085h","","x-ray","1.54184","CuKα","","0.0784","0.0667","","","0.178","0.1869","","","","","","1.048","","","","has coordinates,has disorder","263638","2021-04-05","13:59:47",""
"7127870","30.1143","0.0002","24.4007","0.0002","33.4558","0.0002","90","","95.291","0.001","90","","24478.9","0.3","200","0.1","200","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C378 H300 Ag50 F36 P12 S43 -","- C378 H300 Ag50 F36 P12 S43 -","- C756 H600 Ag100 F72 P24 S86 -","2","0.5","","Sun, Qiao-Qiao; Li, Qian; Li, Hai-Yang; Zhang, Miao-Miao; Sun, Meng-En; Li, Si; Quan, Zewei; Zang, Shuang-Quan","Thermochromism and piezochromism of an atomically precise high-nuclearity silver sulfide nanocluster.","Chemical communications (Cambridge, England)","2021","57","19","2372","2375","10.1039/d0cc07085h","","x-ray","1.54184","CuKα","","0.0937","0.0786","","","0.2248","0.2384","","","","","","1.068","","","","has coordinates,has disorder","263638","2021-04-05","13:59:47",""
"7127871","17.4596","0.0009","18.8819","0.001","19.6255","0.001","103.748","0.004","110.733","0.004","93.756","0.004","5797.3","0.6","120","","120","","","","","","","","","7","P -1","-P 1","2","","","","- C213 H332 Au15.37 Cl2 Cu16.63 O3 S20 -","- C200 H300 Au15.37 Cu16.63 S20 -","- C200 H300 Au15.37 Cu16.63 S20 -","1","0.5","","Tang, Li; Deng, Shiyao; Wang, Shuxin; Pei, Yong; Zhu, Manzhou","Total structural determination of alloyed Au<sub>15.37</sub>Cu<sub>16.63</sub>(S-Adm)<sub>20</sub> nanoclusters with double superatomic chains.","Chemical communications (Cambridge, England)","2021","57","16","2017","2020","10.1039/d0cc07482a","","","1.54186","CuKα","","0.1261","0.0856","","","0.2071","0.2247","","","","","","0.997","","","","has coordinates,has disorder","262481","2021-03-05","01:18:23",""
"7127872","43.518","0.011","18.722","0.005","24.326","0.006","90","","97.866","0.003","90","","19633","9","120","","120","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","(C75H78N6O9)Fe(BF4)2(CHCl3)2.6(C6H6)3.9","","","- C101 H104 B2 Cl7.8 F8 Fe N6 O9 -","- C101 H104 B2 Cl7.8 F8 Fe N6 O9 -","- C808 H832 B16 Cl62.4 F64 Fe8 N48 O72 -","8","1","","Morita, Hiroki; Akine, Shigehisa; Nakamura, Takashi; Nabeshima, Tatsuya","Exclusive formation of a meridional complex of a tripodand and perfect suppression of guest recognition.","Chemical communications (Cambridge, England)","2021","57","17","2124","2127","10.1039/d1cc00146a","","","0.71069","MoKα","","0.1034","0.059","","","0.1457","0.1639","","","","","","1.042","","","","has coordinates,has disorder","262473","2021-03-05","01:16:22",""
"7127873","12.2076","0.0015","22.78","0.003","10.9946","0.0013","90","","105.542","0.002","90","","2945.7","0.6","273.15","","273.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H31 F N2 O3 -","- C37 H31 F N2 O3 -","- C148 H124 F4 N8 O12 -","4","1","","Zhang, Heng; Guan, Xu-Kai; Sun, Dong-Yang; Liu, Guo-Feng; Gao, Ji-Gang; Zhang, Guang-Liang; Zhang, Suo-Qin","Asymmetric syntheses of spiro[benzofuro-cyclopenta[1,2-b]indole-indoline] scaffolds via consecutive cyclization.","Chemical communications (Cambridge, England)","2021","57","18","2313","2316","10.1039/d0cc08083g","","","0.71073","MoKα","","0.132","0.0736","","","0.1888","0.2238","","","","","","1.027","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127874","7.1017","0.0005","8.7972","0.0006","23.5265","0.0017","90","","95.855","0.003","90","","1462.15","0.18","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H17 B10 N S -","- C8 H17 B10 N S -","- C32 H68 B40 N4 S4 -","4","1","","Guo, Shu-Ting; Cui, Peng-Fei; Yuan, Run-Ze; Jin, Guo-Xin","Transition metal-mediated B(4)-H hydroxylation/halogenation of o-carboranes bearing a 2-pyridylsulfenyl ligand.","Chemical communications (Cambridge, England)","2021","57","19","2412","2415","10.1039/d0cc08290b","","","0.71073","MoKα","","0.0549","0.0419","","","0.1071","0.1163","","","","","","1.044","","","","has coordinates","263637","2021-04-05","13:59:07",""
"7127875","13.0313","0.0007","12.7774","0.0007","9.047","0.0004","90","","90","","90","","1506.38","0.13","296","2","296","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C8 H17 B10 N O S -","- C8 H17 B10 N O S -","- C32 H68 B40 N4 O4 S4 -","4","1","","Guo, Shu-Ting; Cui, Peng-Fei; Yuan, Run-Ze; Jin, Guo-Xin","Transition metal-mediated B(4)-H hydroxylation/halogenation of o-carboranes bearing a 2-pyridylsulfenyl ligand.","Chemical communications (Cambridge, England)","2021","57","19","2412","2415","10.1039/d0cc08290b","","","1.34138","GaKα","","0.0653","0.0397","","","0.0941","0.1042","","","","","","1.049","","","","has coordinates","263637","2021-04-05","13:59:08",""
"7127876","8.88","0.003","12.558","0.003","14.122","0.003","90","","90","","90","","1574.8","0.7","200","2","200.01","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C8 H16 B10 Br N S -","- C8 H16 B10 Br N S -","- C32 H64 B40 Br4 N4 S4 -","4","1","","Guo, Shu-Ting; Cui, Peng-Fei; Yuan, Run-Ze; Jin, Guo-Xin","Transition metal-mediated B(4)-H hydroxylation/halogenation of o-carboranes bearing a 2-pyridylsulfenyl ligand.","Chemical communications (Cambridge, England)","2021","57","19","2412","2415","10.1039/d0cc08290b","","","1.34138","GaKα","","0.055","0.0417","","","0.103","0.1088","","","","","","1.022","","","","has coordinates","263637","2021-04-05","13:59:08",""
"7127877","17.146","0.0007","9.4","0.0004","16.8416","0.0007","90","","97.623","0.002","90","","2690.41","0.19","173","2","173.02","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C18 H30 B9 Cl3 N Rh S -","- C18 H30 B9 Cl3 N Rh S -","- C72 H120 B36 Cl12 N4 Rh4 S4 -","4","0.5","","Guo, Shu-Ting; Cui, Peng-Fei; Yuan, Run-Ze; Jin, Guo-Xin","Transition metal-mediated B(4)-H hydroxylation/halogenation of o-carboranes bearing a 2-pyridylsulfenyl ligand.","Chemical communications (Cambridge, England)","2021","57","19","2412","2415","10.1039/d0cc08290b","","","1.34138","GaKα","","0.036","0.0339","","","0.0905","0.0921","","","","","","1.042","","","","has coordinates,has disorder","263637","2021-04-05","13:59:08",""
"7127878","8.7616","0.0003","14.8923","0.0007","18.1794","0.0008","90","","90","","90","","2372.05","0.17","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C17 H29 B10 Cl Ir N S -","- C17 H29 B10 Cl Ir N S -","- C68 H116 B40 Cl4 Ir4 N4 S4 -","4","1","","Guo, Shu-Ting; Cui, Peng-Fei; Yuan, Run-Ze; Jin, Guo-Xin","Transition metal-mediated B(4)-H hydroxylation/halogenation of o-carboranes bearing a 2-pyridylsulfenyl ligand.","Chemical communications (Cambridge, England)","2021","57","19","2412","2415","10.1039/d0cc08290b","","","0.71073","MoKα","","0.029","0.0256","","","0.0495","0.0505","","","","","","1.035","","","","has coordinates","263637","2021-04-05","13:59:08",""
"7127879","15.9981","0.0006","15.7969","0.0005","19.0542","0.0007","90","","90","","90","","4815.4","0.3","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C18 H31 B10 Cl N Rh S -","- C18 H31 B10 Cl N Rh S -","- C144 H248 B80 Cl8 N8 Rh8 S8 -","8","1","","Guo, Shu-Ting; Cui, Peng-Fei; Yuan, Run-Ze; Jin, Guo-Xin","Transition metal-mediated B(4)-H hydroxylation/halogenation of o-carboranes bearing a 2-pyridylsulfenyl ligand.","Chemical communications (Cambridge, England)","2021","57","19","2412","2415","10.1039/d0cc08290b","","","1.34138","GaKα","","0.0627","0.0497","","","0.1219","0.1323","","","","","","1.042","","","","has coordinates","263637","2021-04-05","13:59:08",""
"7127880","9.6689","0.0005","13.6644","0.0008","15.5496","0.0008","103.901","0.003","93.292","0.003","106.301","0.003","1896.81","0.18","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C10 H23 B10 N O S Si -","- C10 H23 B10 N O S Si -","- C40 H92 B40 N4 O4 S4 Si4 -","4","2","","Guo, Shu-Ting; Cui, Peng-Fei; Yuan, Run-Ze; Jin, Guo-Xin","Transition metal-mediated B(4)-H hydroxylation/halogenation of o-carboranes bearing a 2-pyridylsulfenyl ligand.","Chemical communications (Cambridge, England)","2021","57","19","2412","2415","10.1039/d0cc08290b","","","1.54178","CuKα","","0.0497","0.0402","","","0.1059","0.1124","","","","","","1.061","","","","has coordinates","263637","2021-04-05","13:59:08",""
"7127881","16.183","0.002","15.932","0.002","19.224","0.003","90","","90","","90","","4956.5","1.2","296","2","296.15","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C18 H31 B10 Cl Ir N S -","- C18 H31 B10 Cl Ir N S -","- C144 H248 B80 Cl8 Ir8 N8 S8 -","8","1","","Guo, Shu-Ting; Cui, Peng-Fei; Yuan, Run-Ze; Jin, Guo-Xin","Transition metal-mediated B(4)-H hydroxylation/halogenation of o-carboranes bearing a 2-pyridylsulfenyl ligand.","Chemical communications (Cambridge, England)","2021","57","19","2412","2415","10.1039/d0cc08290b","","","0.71073","MoKα","","0.0637","0.0331","","","0.0786","0.0948","","","","","","1.034","","","","has coordinates","263637","2021-04-05","13:59:08",""
"7127882","17.5863","0.0007","5.6213","0.0002","11.9738","0.0005","90","","90","","90","","1183.7","0.08","100","2","100","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C10 H18 B2 N2 -","- C10 H18 B2 N2 -","- C40 H72 B8 N8 -","4","0.5","","Schorr, Fabian; Fantuzzi, Felipe; Dewhurst, Rian D.; Braunschweig, Holger","Dialkynyldiboranes(4) and the selectable reactivity of their C-H, C[triple bond, length as m-dash]C and B-B bonds.","Chemical communications (Cambridge, England)","2021","57","21","2645","2648","10.1039/d1cc00265a","","","0.71073","MoKα","","0.0474","0.0385","","","0.1","0.106","","","","","","1.08","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127883","16.2232","0.0006","10.2407","0.0004","12.6695","0.0005","90","","94.201","0.003","90","","2099.22","0.14","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H30 B2 N2 O Si2 -","- C14 H30 B2 N2 O Si2 -","- C56 H120 B8 N8 O4 Si8 -","4","1","","Schorr, Fabian; Fantuzzi, Felipe; Dewhurst, Rian D.; Braunschweig, Holger","Dialkynyldiboranes(4) and the selectable reactivity of their C-H, C[triple bond, length as m-dash]C and B-B bonds.","Chemical communications (Cambridge, England)","2021","57","21","2645","2648","10.1039/d1cc00265a","","","0.71073","MoKα","","0.0722","0.0431","","","0.1053","0.1181","","","","","","1.011","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127884","17.582","0.003","14.6013","0.0018","11.2104","0.0017","90","","107.223","0.007","90","","2748.9","0.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H14 B2 Co4 N2 O12 -","- C20 H14 B2 Co4 N2 O12 -","- C80 H56 B8 Co16 N8 O48 -","4","0.5","","Schorr, Fabian; Fantuzzi, Felipe; Dewhurst, Rian D.; Braunschweig, Holger","Dialkynyldiboranes(4) and the selectable reactivity of their C-H, C[triple bond, length as m-dash]C and B-B bonds.","Chemical communications (Cambridge, England)","2021","57","21","2645","2648","10.1039/d1cc00265a","","","0.71073","MoKα","","0.054","0.0342","","","0.0614","0.0669","","","","","","0.993","","","","has coordinates","263662","2021-04-05","14:05:54",""
"7127885","18.1518","0.0012","6.7454","0.0004","12.0546","0.0008","90","","124.587","0.002","90","","1215.12","0.14","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H18 B2 N2 O -","- C10 H18 B2 N2 O -","- C40 H72 B8 N8 O4 -","4","0.5","","Schorr, Fabian; Fantuzzi, Felipe; Dewhurst, Rian D.; Braunschweig, Holger","Dialkynyldiboranes(4) and the selectable reactivity of their C-H, C[triple bond, length as m-dash]C and B-B bonds.","Chemical communications (Cambridge, England)","2021","57","21","2645","2648","10.1039/d1cc00265a","","","0.71073","MoKα","","0.0476","0.0431","","","0.1202","0.1241","","","","","","1.116","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127886","28.1055","0.0015","5.9611","0.0004","12.3603","0.0008","90","","103.971","0.003","90","","2009.6","0.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H30 B2 N2 Si2 -","- C14 H30 B2 N2 Si2 -","- C56 H120 B8 N8 Si8 -","4","0.5","","Schorr, Fabian; Fantuzzi, Felipe; Dewhurst, Rian D.; Braunschweig, Holger","Dialkynyldiboranes(4) and the selectable reactivity of their C-H, C[triple bond, length as m-dash]C and B-B bonds.","Chemical communications (Cambridge, England)","2021","57","21","2645","2648","10.1039/d1cc00265a","","","0.71073","MoKα","","0.0422","0.036","","","0.0934","0.0975","","","","","","1.075","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127887","13.8008","0.0009","6.3504","0.0004","12.1141","0.0007","90","","90.588","0.003","90","","1061.63","0.11","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H14 B2 N2 -","- C8 H14 B2 N2 -","- C32 H56 B8 N8 -","4","0.5","","Schorr, Fabian; Fantuzzi, Felipe; Dewhurst, Rian D.; Braunschweig, Holger","Dialkynyldiboranes(4) and the selectable reactivity of their C-H, C[triple bond, length as m-dash]C and B-B bonds.","Chemical communications (Cambridge, England)","2021","57","21","2645","2648","10.1039/d1cc00265a","","","0.71073","MoKα","","0.0469","0.0378","","","0.0956","0.1027","","","","","","1.07","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127888","20.8512","0.0003","21.3528","0.0003","18.4332","0.0003","90","","90","","90","","8207","0.2","100","2","100","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C110 H134 B8 Co16 N8 O48 Si8 -","- C110 H134 B8 Co16 N8 O48 Si8 -","- C220 H268 B16 Co32 N16 O96 Si16 -","2","0.25","","Schorr, Fabian; Fantuzzi, Felipe; Dewhurst, Rian D.; Braunschweig, Holger","Dialkynyldiboranes(4) and the selectable reactivity of their C-H, C[triple bond, length as m-dash]C and B-B bonds.","Chemical communications (Cambridge, England)","2021","57","21","2645","2648","10.1039/d1cc00265a","","","0.71073","MoKα","","0.0634","0.0575","","","0.1396","0.1417","","","","","","1.349","","","","has coordinates,has disorder","263662","2021-04-05","14:05:54",""
"7127889","15.6359","0.0006","11.9136","0.0005","16.381","0.0006","90","","102.757","0.002","90","","2976.1","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 B2 Co4 N2 O12 -","- C22 H18 B2 Co4 N2 O12 -","- C88 H72 B8 Co16 N8 O48 -","4","1","","Schorr, Fabian; Fantuzzi, Felipe; Dewhurst, Rian D.; Braunschweig, Holger","Dialkynyldiboranes(4) and the selectable reactivity of their C-H, C[triple bond, length as m-dash]C and B-B bonds.","Chemical communications (Cambridge, England)","2021","57","21","2645","2648","10.1039/d1cc00265a","","","0.71073","MoKα","","0.0379","0.0289","","","0.0679","0.0716","","","","","","1.04","","","","has coordinates","263662","2021-04-05","14:05:54",""
"7127890","10.689","0.003","11.002","0.003","13.971","0.002","87.527","0.017","79.02","0.014","74.46","0.009","1553.9","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C6 H7.5 Ag2 B11 Br6 I5 N2.5 -","- C6 H6 Ag2 B11 Br6 I5 N2.5 -","- C12 H12 Ag4 B22 Br12 I10 N5 -","2","1","","Wan, Rong; Liu, Zhen; Ma, Xinyi; Li, Huafeng; Ma, Pengtao; Zhang, Chao; Niu, Jingyang; Wang, Jingping","Discovery of two Na<sup>+</sup>-centered Silverton-type polyoxometalates {NaM<sub>12</sub>O<sub>42</sub>} (M = Mo, W).","Chemical communications (Cambridge, England)","2021","57","17","2172","2175","10.1039/d0cc07590f","","","0.71073","MoKα","","0.094","0.0693","","","0.1717","0.1883","","","","","","1.079","","","","has coordinates,has disorder","262474","2021-03-05","01:16:42",""
"7127891","17.9539","0.0009","17.9539","0.0009","17.9539","0.0009","90","","90","","90","","5787.3","0.5","296","2","296.15","","","","","","","","","7","P -4 3 n","P -4n 2 3","218","","","","- C24 H72 Na4 O57 Ru4 S12 W12 -","- C24 H72 Na4 O57 Ru4 S12 W12 -","- C48 H144 Na8 O114 Ru8 S24 W24 -","2","0.0833333","","Wan, Rong; Liu, Zhen; Ma, Xinyi; Li, Huafeng; Ma, Pengtao; Zhang, Chao; Niu, Jingyang; Wang, Jingping","Discovery of two Na<sup>+</sup>-centered Silverton-type polyoxometalates {NaM<sub>12</sub>O<sub>42</sub>} (M = Mo, W).","Chemical communications (Cambridge, England)","2021","57","17","2172","2175","10.1039/d0cc07590f","","","0.71073","MoKα","","0.0397","0.0277","","","0.072","0.0779","","","","","","1.124","","","","has coordinates","262474","2021-03-05","01:16:45",""
"7127892","25.774","0.003","17.2923","0.0018","17.006","0.0018","90","","92.749","0.003","90","","7570.7","1.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H58.68 B2 N -","- C43 H58.6795 B2 N -","- C344 H469.436 B16 N8 -","8","2","","Crumbach, Merian; Ayhan, Ozan; Fritze, Lars; Sprenger, Jan A. P.; Zapf, Ludwig; Finze, Maik; Helten, Holger","BNB-doped phenalenyls - aromaticity switch upon one-electron reduction.","Chemical communications (Cambridge, England)","2021","57","19","2408","2411","10.1039/d0cc07671f","","","0.71073","MoKα","","0.1529","0.0694","","","0.1473","0.1824","","","","","","1.022","","","","has coordinates,has disorder","263639","2021-04-05","13:59:59",""
"7127893","20.0781","0.0007","7.6006","0.0003","22.0644","0.0007","90","","100.534","0.001","90","","3310.4","0.2","100","2","100.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C31.45 H17.45 B2 Cl1.36 F18 N O0 -","- C31.456 H17.456 B2 Cl1.368 F18 N -","- C125.824 H69.824 B8 Cl5.472 F72 N4 -","4","1","","Crumbach, Merian; Ayhan, Ozan; Fritze, Lars; Sprenger, Jan A. P.; Zapf, Ludwig; Finze, Maik; Helten, Holger","BNB-doped phenalenyls - aromaticity switch upon one-electron reduction.","Chemical communications (Cambridge, England)","2021","57","19","2408","2411","10.1039/d0cc07671f","","","0.71073","MoKα","","0.086","0.0663","","","0.1653","0.1801","","","","","","1.063","","","","has coordinates,has disorder","263639","2021-04-05","14:00:00",""
"7127894","28.0551","0.0004","17.812","0.0002","28.6373","0.0004","90","","104.597","0.002","90","","13848.6","0.3","93","2","93","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5,10-bis(p-trifluoromethylphenyl)-1,14-dibenzylaminotripyrrin","","- C84 H62 F12 N10 -","- C84 H62 F12 N10 -","- C672 H496 F96 N80 -","8","1","","Ueta, Kento; Umetani, Masataka; Osuka, Atsuhiro; Pantoş, G Dan; Tanaka, Takayuki","Single- and double-helices of α,α'-dibenzylaminotripyrrin: solution and solid state studies.","Chemical communications (Cambridge, England)","2021","57","21","2617","2620","10.1039/d1cc00208b","","","1.54184","CuKα","","0.0703","0.0544","","","0.1486","0.1606","","","","","","1.047","","","","has coordinates,has disorder","263663","2021-04-05","14:06:05",""
"7127895","17.8208","0.0016","7.0277","0.0007","19.5682","0.0018","90","","90","","90","","2450.7","0.4","173","","173","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C12 H12 Br Cl O2 -","- C12 H12 Br Cl O2 -","- C96 H96 Br8 Cl8 O16 -","8","1","","Yoshida, Yasushi; Ishikawa, Seitaro; Mino, Takashi; Sakamoto, Masami","Bromonium salts: diaryl-λ<sup>3</sup>-bromanes as halogen-bonding organocatalysts.","Chemical communications (Cambridge, England)","2021","57","20","2519","2522","10.1039/d0cc07733j","","","1.54178","CuKα","","0.0281","0.0277","","","0.0743","0.0748","","","","","","1.053","","","","has coordinates","263646","2021-04-05","14:01:46",""
"7127896","8.243","0.0002","28.1258","0.0008","7.5353","0.0002","90","","105.165","0.001","90","","1686.15","0.08","170","2","170","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 N2 O5 S -","- C18 H16 N2 O5 S -","- C72 H64 N8 O20 S4 -","4","1","","Jia, Tingting; Zeng, Gongruixue; Zhang, Chong; Zeng, Linghui; Zheng, Wenya; Li, Siyao; Wu, Keyi; Shao, Jiaan; Zhang, Jiankang; Zhu, Huajian","The reaction of prop-2-ynylsulfonium salts and sulfonyl-protected β-amino ketones to epoxide-fused 2-methylenepyrrolidines and S-containing pyrroles.","Chemical communications (Cambridge, England)","2021","57","21","2657","2660","10.1039/d0cc07745c","","","0.71073","MoKα","","0.0393","0.0367","","","0.0936","0.0962","","","","","","1.065","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127897","14.1295","0.0004","9.5636","0.0003","14.5227","0.0004","90","","102.422","0.001","90","","1916.5","0.1","170","2","170","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N O3 S2 -","- C20 H21 N O3 S2 -","- C80 H84 N4 O12 S8 -","4","1","","Jia, Tingting; Zeng, Gongruixue; Zhang, Chong; Zeng, Linghui; Zheng, Wenya; Li, Siyao; Wu, Keyi; Shao, Jiaan; Zhang, Jiankang; Zhu, Huajian","The reaction of prop-2-ynylsulfonium salts and sulfonyl-protected β-amino ketones to epoxide-fused 2-methylenepyrrolidines and S-containing pyrroles.","Chemical communications (Cambridge, England)","2021","57","21","2657","2660","10.1039/d0cc07745c","","","0.71073","MoKα","","0.0338","0.0308","","","0.0852","0.0878","","","","","","1.051","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127898","13.817","0.001","27.779","0.002","19.3544","0.0013","90","","107.003","0.002","90","","7103.9","0.9","135","2","135","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C71 H92 F2 Ge N6 S6 -","- C71 H92 F2 Ge N6 S6 -","- C284 H368 F8 Ge4 N24 S24 -","4","1","","Tran, Phuong M.; Wang, Yuzhong; Xie, Yaoming; Wei, Pingrong; Schaefer, 3rd, Henry F; Robinson, Gregory H.","Carbene-mediated synthesis of a germanium tris(dithiolene)dianion.","Chemical communications (Cambridge, England)","2021","57","20","2543","2546","10.1039/d0cc08206f","","","0.71073","MoKα","","0.0622","0.04","","","0.0812","0.0886","","","","","","1.043","","","","has coordinates","263642","2021-04-05","14:01:06",""
"7127899","18.9013","0.0012","22.8865","0.0015","32.511","0.002","82.466","0.002","86.258","0.002","88.632","0.002","13911","1.5","135","2","135","2","","","","","","","","7","P -1","-P 1","2","","","","- C276 H362 Cl2 F16 Ge2 N24 S18 -","- C276 H362 Cl2 F16 Ge2 N24 S18 -","- C552 H724 Cl4 F32 Ge4 N48 S36 -","2","1","","Tran, Phuong M.; Wang, Yuzhong; Xie, Yaoming; Wei, Pingrong; Schaefer, 3rd, Henry F; Robinson, Gregory H.","Carbene-mediated synthesis of a germanium tris(dithiolene)dianion.","Chemical communications (Cambridge, England)","2021","57","20","2543","2546","10.1039/d0cc08206f","","","0.71073","MoKα","","0.1413","0.0692","","","0.1415","0.1717","","","","","","1.004","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127900","13.5246","0.0011","14.1422","0.0011","20.78","0.0015","78.353","0.003","76.753","0.002","63.302","0.002","3433.9","0.5","149.98","","149.98","","","","","","","","","6","P -1","-P 1","2","","","","- C53 H86.68 Fe N3 O22 Ti5 -","- C53 H86.69 Fe N3 O22 Ti5 -","- C106 H173.38 Fe2 N6 O44 Ti10 -","2","1","","Han, Er-Meng; Yu, Wei-Dong; Li, Lei-Jiao; Yi, Xiao-Yi; Yan, Jun; Liu, Chao","Accurate assembly of ferrocene-functionalized {Ti22Fc4} clusters with photocatalytic amine oxidation activity.","Chemical communications (Cambridge, England)","2021","57","22","2792","2795","10.1039/d1cc00019e","","x-ray","0.71073","MoKα","","0.064","0.0474","","","0.1186","0.1335","","","","","","1.022","","","","has coordinates,has disorder","263619","2021-04-05","13:53:04",""
"7127901","21.8611","0.0006","21.3692","0.0005","25.6759","0.0009","90","","110.058","0.003","90","","11267.1","0.6","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C83 H137 Fe2 N10 O39 Ti11 -","- C83 H137 Fe2 N10 O40 Ti11 -","- C332 H548 Fe8 N40 O160 Ti44 -","4","1","","Han, Er-Meng; Yu, Wei-Dong; Li, Lei-Jiao; Yi, Xiao-Yi; Yan, Jun; Liu, Chao","Accurate assembly of ferrocene-functionalized {Ti22Fc4} clusters with photocatalytic amine oxidation activity.","Chemical communications (Cambridge, England)","2021","57","22","2792","2795","10.1039/d1cc00019e","","x-ray","1.54184","CuKα","","0.1018","0.0675","","","0.1689","0.1951","","","","","","1.031","","","","has coordinates,has disorder","263619","2021-04-05","13:53:06",""
"7127902","22.0941","0.0006","22.6404","0.0007","25.2924","0.0008","114.715","0.001","95.411","0.001","91.836","0.001","11405.8","0.6","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C166 H273.12 Fe4 N12 O80 Ti22 -","- C166 H273.11 Fe4 N12 O80 Ti22 -","- C332 H546.22 Fe8 N24 O160 Ti44 -","2","1","","Han, Er-Meng; Yu, Wei-Dong; Li, Lei-Jiao; Yi, Xiao-Yi; Yan, Jun; Liu, Chao","Accurate assembly of ferrocene-functionalized {Ti22Fc4} clusters with photocatalytic amine oxidation activity.","Chemical communications (Cambridge, England)","2021","57","22","2792","2795","10.1039/d1cc00019e","","x-ray","0.71073","MoKα","","0.1631","0.0858","","","0.2366","0.2683","","","","","","1.073","","","","has coordinates,has disorder","263619","2021-04-05","13:53:06",""
"7127903","13.4567","0.0003","13.4567","0.0003","13.4567","0.0003","90","","90","","90","","2436.78","0.09","293","2","293","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C24 K12 Mn4 Na4 O48 -","- C24 K12 Mn4 Na4 O48 -","- C48 K24 Mn8 Na8 O96 -","2","0.0416667","","He, Xiaolong; Zhang, Xinyuan; Ji, Bifa; Yao, Wenjiao; Lightfoot, Philip; Tang, Yongbing","Tilting and twisting in a novel perovzalate, K<sub>3</sub>NaMn(C<sub>2</sub>O<sub>4</sub>)<sub>3</sub>.","Chemical communications (Cambridge, England)","2021","57","20","2567","2570","10.1039/d1cc00085c","","","0.71073","MoKα","","0.0216","0.0209","","","0.0604","0.0608","","","","","","1.156","","","","has coordinates","263647","2021-04-05","14:01:54",""
"7127904","25.01159","0.00015","19.41543","0.00012","33.7313","0.0002","90","","100.884","0.0006","90","","16085.6","0.17","119.99","0.1","119.99","0.1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C151 H250 Al4 K4 N8 O4 S4 Si8 -","- C112 H184 Al4 K4 N8 O4 S4 Si8 -","- C448 H736 Al16 K16 N32 O16 S16 Si32 -","4","1","","Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Rajabi, Nasir A.; Coles, Martyn P.","Double insertion of CO<sub>2</sub> into an Al-Te multiple bond.","Chemical communications (Cambridge, England)","2021","57","21","2673","2676","10.1039/d0cc07448a","","x-ray","1.54184","CuKα","","0.0485","0.0386","","","0.1063","0.1123","","","","","","1.024","","","","has coordinates","263661","2021-04-05","14:05:23",""
"7127905","15.2809","0.0002","13.31491","0.00014","20.2359","0.0003","90","","92.7748","0.0013","90","","4112.45","0.09","120","0.1","120","0.1","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C36 H62 Al K N2 O3 Si2 Te -","- C36 H62 Al K N2 O3 Si2 Te -","- C144 H248 Al4 K4 N8 O12 Si8 Te4 -","4","1","","Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Rajabi, Nasir A.; Coles, Martyn P.","Double insertion of CO<sub>2</sub> into an Al-Te multiple bond.","Chemical communications (Cambridge, England)","2021","57","21","2673","2676","10.1039/d0cc07448a","","x-ray","1.54184","CuKα","","0.0356","0.0333","","","0.0879","0.0901","","","","","","1.027","","","","has coordinates,has disorder","263661","2021-04-05","14:05:23",""
"7127906","12.27766","0.00009","24.87997","0.00017","14.9006","0.00011","90","","94.3187","0.0006","90","","4538.73","0.06","150.01","0.1","150.01","0.1","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C74 H132 Al2 K2 N4 O10 S2 Si4 -","- C74 H132 Al2 K2 N4 O10 S2 Si4 -","- C148 H264 Al4 K4 N8 O20 S4 Si8 -","2","1","","Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Rajabi, Nasir A.; Coles, Martyn P.","Double insertion of CO<sub>2</sub> into an Al-Te multiple bond.","Chemical communications (Cambridge, England)","2021","57","21","2673","2676","10.1039/d0cc07448a","","x-ray","1.54184","CuKα","","0.0365","0.0356","","","0.0955","0.0965","","","","","","1.022","","","","has coordinates,has disorder","263661","2021-04-05","14:05:23",""
"7127907","16.8489","0.0003","31.0207","0.0005","19.9738","0.0006","90","","90","","90","","10439.6","0.4","149.99","0.11","149.99","0.11","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C84 H149.017 Al2 K2 N4 O16 Si4 Te2 -","- C84 H149 Al2 K2 N4 O16 Si4 Te2 -","- C336 H596 Al8 K8 N16 O64 Si16 Te8 -","4","1","","Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Rajabi, Nasir A.; Coles, Martyn P.","Double insertion of CO<sub>2</sub> into an Al-Te multiple bond.","Chemical communications (Cambridge, England)","2021","57","21","2673","2676","10.1039/d0cc07448a","","x-ray","0.71073","MoKα","","0.1074","0.0652","","","0.1378","0.1598","","","","","","1.021","","","","has coordinates,has disorder","263661","2021-04-05","14:05:23",""
"7127908","10.0626","0.0004","17.1004","0.0006","17.2361","0.0006","88.851","0.003","83.037","0.003","84.293","0.003","2929.33","0.19","149.95","0.15","149.95","0.15","","","","","","","","8","P -1","-P 1","2","","","","- C50 H90 Al K N4 O8 S Si2 -","- C50 H90 Al K N4 O8 S Si2 -","- C100 H180 Al2 K2 N8 O16 S2 Si4 -","2","1","","Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Rajabi, Nasir A.; Coles, Martyn P.","Double insertion of CO<sub>2</sub> into an Al-Te multiple bond.","Chemical communications (Cambridge, England)","2021","57","21","2673","2676","10.1039/d0cc07448a","","x-ray","1.54184","CuKα","","0.0876","0.0612","","","0.1382","0.151","","","","","","1.083","","","","has coordinates,has disorder","263661","2021-04-05","14:05:23",""
"7127909","15.4374","0.0002","13.47603","0.00018","22.5971","0.0003","90","","93.2318","0.0013","90","","4693.51","0.11","119.98","0.1","119.98","0.1","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C82 H140 Al2 K2 N4 O12 Se2 Si4 -","- C82 H140 Al2 K2 N4 O12 Se2 Si4 -","- C164 H280 Al4 K4 N8 O24 Se4 Si8 -","2","0.5","","Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Rajabi, Nasir A.; Coles, Martyn P.","Double insertion of CO<sub>2</sub> into an Al-Te multiple bond.","Chemical communications (Cambridge, England)","2021","57","21","2673","2676","10.1039/d0cc07448a","","x-ray","1.54184","CuKα","","0.0436","0.035","","","0.0866","0.0918","","","","","","1.006","","","","has coordinates","263661","2021-04-05","14:05:23",""
"7127910","10.9554","0.0013","16.2655","0.0017","7.9831","0.0008","90","","109.324","0.012","90","","1342.4","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H15 Br3 Cl N Pb -","- C7 H15 Br3 Cl N Pb -","- C28 H60 Br12 Cl4 N4 Pb4 -","4","1","","Qi, Zhikai; Chen, Yali; Guo, Yao; Yang, Xuelian; Gao, Huizhi; Zhou, Guojun; Li, Shi-Li; Zhang, Xian-Ming","Highly efficient self-trapped exciton emission in a one-dimensional face-shared hybrid lead bromide.","Chemical communications (Cambridge, England)","2021","57","20","2495","2498","10.1039/d0cc08218j","","x-ray","0.71073","MoKα","","0.1724","0.1128","","","0.2531","0.3068","","","","","","1.059","","","","has coordinates","263648","2021-04-05","14:02:01",""
"7127911","7.9537","0.0004","9.3223","0.0004","10.83","0.0005","84.687","0.003","74.704","0.003","69.975","0.002","727.73","0.06","173","2","173","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H13 Cl N2 O3 -","- C16 H13 Cl N2 O3 -","- C32 H26 Cl2 N4 O6 -","2","1","","Zhang, Xia-Yan; Dou, Pei-Hao; Lu, Wen-Ya; You, Yong; Zhao, Jian-Qiang; Wang, Zhen-Hua; Yuan, Wei-Cheng","Benzylidene succinimides as 3C synthons for the asymmetric tandem Mannich reaction/transamidation of cyclic trifluoromethyl ketimines to obtain F<sub>3</sub>C-containing polycyclic dihydroquinazolinones.","Chemical communications (Cambridge, England)","2021","57","23","2927","2930","10.1039/d0cc08131k","","","1.34139","GaKα","","0.0577","0.0476","","","0.1171","0.1265","","","","","","1.066","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127912","9.5411","0.0003","13.6581","0.0005","12.605","0.0004","90","","89.913","0.003","90","","1642.6","0.09","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C33 H29 Cl F3 N3 O6 -","- C33 H29 Cl F3 N3 O6 -","- C66 H58 Cl2 F6 N6 O12 -","2","1","","Zhang, Xia-Yan; Dou, Pei-Hao; Lu, Wen-Ya; You, Yong; Zhao, Jian-Qiang; Wang, Zhen-Hua; Yuan, Wei-Cheng","Benzylidene succinimides as 3C synthons for the asymmetric tandem Mannich reaction/transamidation of cyclic trifluoromethyl ketimines to obtain F<sub>3</sub>C-containing polycyclic dihydroquinazolinones.","Chemical communications (Cambridge, England)","2021","57","23","2927","2930","10.1039/d0cc08131k","","x-ray","1.54184","CuKα","","0.0578","0.0481","","","0.1274","0.136","","","","","","1.03","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127913","17.6122","0.001","22.2298","0.0014","26.3632","0.0014","70.629","0.004","81.477","0.003","72.911","0.004","9292.7","1","173","2","173","","","","","","","","","7","P -1","-P 1","2","","","","- C178 H190 F18 N12 O34 Rh6 S6 -","- C148 H132 F12 N6 O24 Rh6 S4 -","- C296 H264 F24 N12 O48 Rh12 S8 -","2","1","","Zhang, Ying-Ying; Qiu, Feng-Yi; Shi, Hua-Tian; Yu, Weibin","Self-assembly and guest-induced disassembly of triply interlocked [2]catenanes.","Chemical communications (Cambridge, England)","2021","57","24","3010","3013","10.1039/d0cc08052g","","","1.54178","CuKα","","0.0951","0.069","","","0.2068","0.2283","","","","","","1.08","","","","has coordinates","263616","2021-04-05","13:52:25",""
"7127914","35.2854","0.0019","32.1734","0.0018","37.719","0.002","90","","101.939","0.003","90","","41894","4","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C172 H200 F18 N6 O51 Rh6 S6 -","- C156 H138 N6 O12 Rh6 -","- C1248 H1104 N48 O96 Rh48 -","8","2","","Zhang, Ying-Ying; Qiu, Feng-Yi; Shi, Hua-Tian; Yu, Weibin","Self-assembly and guest-induced disassembly of triply interlocked [2]catenanes.","Chemical communications (Cambridge, England)","2021","57","24","3010","3013","10.1039/d0cc08052g","","","1.34138","GaKα","","0.2288","0.1843","","","0.3926","0.4126","","","","","","1.122","","","","has coordinates","263616","2021-04-05","13:52:26",""
"7127915","16.902","0.002","16.902","0.002","83.022","0.01","90","","90","","120","","20540","4","173","2","173","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C114 H102 Cl24 N36 O18 Re6 -","- C102 H78 Cl12 N36 O18 Re6 -","- C612 H468 Cl72 N216 O108 Re36 -","6","0.166667","","Tadokoro, Makoto; Machida, Hironobu; Toyofuku, Ryuji; Murakami, Megumi; Kamebuchi, Hajime; Isoda, Kyosuke; Kobayashi, Fumiya; Takahashi, Kiyonori; Noro, Shin'ichiro; Nakamura, Takayoshi","Gas sorption of nano-porous supramolecules formed by multi-hydrogen bonded coordination capsules.","Chemical communications (Cambridge, England)","2021","57","18","2249","2252","10.1039/d0cc07869g","","","0.71073","MoKα","","0.0726","0.0659","","","0.1782","0.1816","","","","","","1.115","","","","has coordinates","262505","2021-03-05","01:22:46",""
"7127916","15.5799","0.0008","13.3433","0.0007","14.166","0.0007","90","","92.824","0.002","90","","2941.4","0.3","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 N8 Ni O6 -","- C30 H26 N8 Ni O6 -","- C120 H104 N32 Ni4 O24 -","4","1","","Cabelof, Alyssa C.; Carta, Veronica; Caulton, Kenneth G.","A proton-responsive ligand becomes a dimetal linker for multisubstrate assembly <i>via</i> nitrate deoxygenation.","Chemical communications (Cambridge, England)","2021","57","22","2780","2783","10.1039/d0cc07886g","","","0.71073","MoKα","","0.0514","0.0336","","","0.0721","0.078","","","","","","1.009","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127917","9.3273","0.0004","10.2918","0.0005","10.8763","0.0005","95.137","0.002","95.8","0.002","107.67","0.002","981.73","0.08","123","","123","","","","","","","","","6","P -1","-P 1","2","","","","- C19 H21 Br2 N3 Ni O -","- C19 H21 Br2 N3 Ni O -","- C38 H42 Br4 N6 Ni2 O2 -","2","1","","Cabelof, Alyssa C.; Carta, Veronica; Caulton, Kenneth G.","A proton-responsive ligand becomes a dimetal linker for multisubstrate assembly <i>via</i> nitrate deoxygenation.","Chemical communications (Cambridge, England)","2021","57","22","2780","2783","10.1039/d0cc07886g","","","0.71073","MoKα","","0.0388","0.0327","","","0.0855","0.089","","","","","","1.052","","","","has coordinates","263622","2021-04-05","13:53:47",""
"7127918","7.136","0.0003","8.8312","0.0003","13.1888","0.0005","72.909","0.002","79.406","0.002","87.141","0.002","780.9","0.05","123","","123","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H26 Br4 N6 Ni2 -","- C30 H26 Br4 N6 Ni2 -","- C30 H26 Br4 N6 Ni2 -","1","0.5","","Cabelof, Alyssa C.; Carta, Veronica; Caulton, Kenneth G.","A proton-responsive ligand becomes a dimetal linker for multisubstrate assembly <i>via</i> nitrate deoxygenation.","Chemical communications (Cambridge, England)","2021","57","22","2780","2783","10.1039/d0cc07886g","","","0.71073","MoKα","","0.0203","0.0176","","","0.0375","0.0384","","","","","","1.084","","","","has coordinates","263622","2021-04-05","13:53:47",""
"7127919","14.0747","0.0015","8.1646","0.001","24.161","0.003","90","","96.931","0.004","90","","2756.2","0.6","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H24 N8 Ni2 O2 -","- C30 H24 N8 Ni2 O2 -","- C120 H96 N32 Ni8 O8 -","4","1","","Cabelof, Alyssa C.; Carta, Veronica; Caulton, Kenneth G.","A proton-responsive ligand becomes a dimetal linker for multisubstrate assembly <i>via</i> nitrate deoxygenation.","Chemical communications (Cambridge, England)","2021","57","22","2780","2783","10.1039/d0cc07886g","","","0.71073","MoKα","","0.0437","0.0319","","","0.0795","0.0868","","","","","","1.029","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127920","8.0659","0.0003","9.0221","0.0003","12.137","0.0005","90.507","0.001","106.951","0.001","100.125","0.001","830","0.05","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H30 Br2 N8 Ni2 -","- C34 H30 Br2 N8 Ni2 -","- C34 H30 Br2 N8 Ni2 -","1","0.5","","Cabelof, Alyssa C.; Carta, Veronica; Caulton, Kenneth G.","A proton-responsive ligand becomes a dimetal linker for multisubstrate assembly <i>via</i> nitrate deoxygenation.","Chemical communications (Cambridge, England)","2021","57","22","2780","2783","10.1039/d0cc07886g","","","0.71073","MoKα","","0.048","0.0324","","","0.0666","0.0713","","","","","","1.008","","","","has coordinates","263622","2021-04-05","13:53:47",""
"7127921","15.327","0.003","26.533","0.006","15.588","0.004","90","","102.497","0.007","90","","6189","2","173.15","","173.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H25 N7 Ni O3 -","- C30 H25 N7 Ni O3 -","- C240 H200 N56 Ni8 O24 -","8","2","","Cabelof, Alyssa C.; Carta, Veronica; Caulton, Kenneth G.","A proton-responsive ligand becomes a dimetal linker for multisubstrate assembly <i>via</i> nitrate deoxygenation.","Chemical communications (Cambridge, England)","2021","57","22","2780","2783","10.1039/d0cc07886g","","","0.71073","MoKα","","0.2075","0.067","","","0.1367","0.1869","","","","","","0.918","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127922","9.1482","0.0009","12.6677","0.0013","19.356","0.002","98.241","0.003","97.455","0.003","99.31","0.003","2163.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H18 F3 N O3 S -","- C24 H18 F3 N O3 S -","- C96 H72 F12 N4 O12 S4 -","4","2","","Yao, Yanfang; Yin, Ziqing; He, Fu-Sheng; Qin, Xuwei; Xie, Wenlin; Wu, Jie","Photoinduced intramolecular carbosulfonylation of alkynes: access to sulfone-containing dibenzazepines from sulfur dioxide.","Chemical communications (Cambridge, England)","2021","57","23","2883","2886","10.1039/d0cc07927h","","","1.34138","GaKα","","0.0598","0.0575","","","0.1786","0.1815","","","","","","1.061","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127923","9.2682","0.0003","11.942","0.0002","12.8815","0.0003","72.119","0.002","75.806","0.002","85.257","0.002","1315.4","0.06","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C29 H42 N4 -","- C29 H42 N4 -","- C58 H84 N8 -","2","1","","Denker, Lars; Trzaskowski, Bartosz; Frank, René","""Give me five"" - an amino imidazoline-2-imine ligand stabilises the first neutral five-membered cyclic triel(I) carbenoides.","Chemical communications (Cambridge, England)","2021","57","22","2816","2819","10.1039/d1cc00010a","","","1.54184","CuKα","","0.0408","0.0398","","","0.1013","0.1021","","","","","","1.022","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127924","10.7878","0.0005","11.4686","0.0005","13.0738","0.0004","92.946","0.003","94.35","0.003","101.494","0.004","1576.83","0.11","101","2","101","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H41 Al I2 N4 -","- C29 H41 Al I2 N4 -","- C58 H82 Al2 I4 N8 -","2","1","","Denker, Lars; Trzaskowski, Bartosz; Frank, René","""Give me five"" - an amino imidazoline-2-imine ligand stabilises the first neutral five-membered cyclic triel(I) carbenoides.","Chemical communications (Cambridge, England)","2021","57","22","2816","2819","10.1039/d1cc00010a","","","0.71073","MoKα","","0.0458","0.036","","","0.1005","0.1074","","","","","","1.071","","","","has coordinates","263624","2021-04-05","13:54:42",""
"7127925","22.5974","0.0002","10.01899","0.00009","28.1598","0.0003","90","","100.727","0.001","90","","6264.06","0.11","100","0.02","100","0.02","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C70 H94 Al2 N8 -","- C70 H94 Al2 N8 -","- C280 H376 Al8 N32 -","4","0.5","","Denker, Lars; Trzaskowski, Bartosz; Frank, René","""Give me five"" - an amino imidazoline-2-imine ligand stabilises the first neutral five-membered cyclic triel(I) carbenoides.","Chemical communications (Cambridge, England)","2021","57","22","2816","2819","10.1039/d1cc00010a","","","1.54184","CuKα","","0.0389","0.0369","","","0.0972","0.0986","","","","","","1.025","","","","has coordinates","263624","2021-04-05","13:54:42",""
"7127926","29.0327","0.0007","9.5324","0.0002","20.7873","0.0006","90","","96.762","0.002","90","","5712.9","0.2","100","0.1","100","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H41 Ga N4 -","- C29 H41 Ga N4 -","- C232 H328 Ga8 N32 -","8","1","","Denker, Lars; Trzaskowski, Bartosz; Frank, René","""Give me five"" - an amino imidazoline-2-imine ligand stabilises the first neutral five-membered cyclic triel(I) carbenoides.","Chemical communications (Cambridge, England)","2021","57","22","2816","2819","10.1039/d1cc00010a","","","0.71073","MoKα","","0.0572","0.0399","","","0.0893","0.096","","","","","","1.034","","","","has coordinates","263624","2021-04-05","13:54:42",""
"7127927","21.5254","0.0002","10.2619","0.0001","30.784","0.0003","90","","94.43","0.001","90","","6779.61","0.11","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H41 Fe Ga N4 O4 -","- C33 H41 Fe Ga N4 O4 -","- C264 H328 Fe8 Ga8 N32 O32 -","8","1","","Denker, Lars; Trzaskowski, Bartosz; Frank, René","""Give me five"" - an amino imidazoline-2-imine ligand stabilises the first neutral five-membered cyclic triel(I) carbenoides.","Chemical communications (Cambridge, England)","2021","57","22","2816","2819","10.1039/d1cc00010a","","","0.71073","MoKα","","0.0396","0.0316","","","0.0787","0.0817","","","","","","1.039","","","","has coordinates","263624","2021-04-05","13:54:42",""
"7127928","17.06791","0.00019","9.46993","0.00003","28.679","0.0003","90","","142.49","0.002","90","","2822.52","0.14","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H41 In N4 -","- C29 H41 In N4 -","- C116 H164 In4 N16 -","4","1","","Denker, Lars; Trzaskowski, Bartosz; Frank, René","""Give me five"" - an amino imidazoline-2-imine ligand stabilises the first neutral five-membered cyclic triel(I) carbenoides.","Chemical communications (Cambridge, England)","2021","57","22","2816","2819","10.1039/d1cc00010a","","","1.54184","CuKα","","0.0267","0.0266","","","0.0708","0.0709","","","","","","1.056","","","","has coordinates","263624","2021-04-05","13:54:42",""
"7127929","17.0492","0.0001","9.3814","0.0001","18.4404","0.0001","90","","107.63","0.001","90","","2810.93","0.04","101","2","101","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H41 N4 Tl -","- C29 H41 N4 Tl -","- C116 H164 N16 Tl4 -","4","1","","Denker, Lars; Trzaskowski, Bartosz; Frank, René","""Give me five"" - an amino imidazoline-2-imine ligand stabilises the first neutral five-membered cyclic triel(I) carbenoides.","Chemical communications (Cambridge, England)","2021","57","22","2816","2819","10.1039/d1cc00010a","","","0.71073","MoKα","","0.0433","0.0301","","","0.0561","0.0585","","","","","","1.093","","","","has coordinates","263624","2021-04-05","13:54:42",""
"7127930","8.0986","0.0003","9.9827","0.0004","11.1882","0.0004","87.935","0.003","77.417","0.004","73.219","0.003","844.85","0.06","151","40","151","40","","","","","","","","3","P -1","-P 1","2","","","","- C20 H23 N4 -","- C20 H22 N4 -","- C40 H44 N8 -","2","1","","Hierlmeier, Gabriele; Uttendorfer, Maria K.; Wolf, Robert","Di-<i>tert</i>-butyldiphosphatetrahedrane as a building block for phosphaalkenes and phosphirenes.","Chemical communications (Cambridge, England)","2021","57","19","2356","2359","10.1039/d0cc07103j","","x-ray","1.54184","CuKα","","0.0608","0.0572","","","0.159","0.1629","","","","","","1.044","","","","has coordinates,has disorder","263635","2021-04-05","13:58:42",""
"7127931","11.8598","0.0002","18.0388","0.0003","17.3344","0.0002","90","","92.713","0.001","90","","3704.31","0.1","123.01","0.1","123.01","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C37 H54 N2 P2 -","- C37 H54 N2 P2 -","- C148 H216 N8 P8 -","4","1","","Hierlmeier, Gabriele; Uttendorfer, Maria K.; Wolf, Robert","Di-<i>tert</i>-butyldiphosphatetrahedrane as a building block for phosphaalkenes and phosphirenes.","Chemical communications (Cambridge, England)","2021","57","19","2356","2359","10.1039/d0cc07103j","","x-ray","1.54184","CuKα","","0.039","0.0363","","","0.0964","0.0987","","","","","","1.045","","","","has coordinates,has disorder","263635","2021-04-05","13:58:42",""
"7127932","7.5819","0.0002","12.0396","0.0004","15.5332","0.0006","87.68","0.003","88.235","0.003","72.214","0.003","1348.79","0.08","123","0.1","123","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C14 H17 N3 S -","- C14 H17 N3 S -","- C56 H68 N12 S4 -","4","2","","Hierlmeier, Gabriele; Uttendorfer, Maria K.; Wolf, Robert","Di-<i>tert</i>-butyldiphosphatetrahedrane as a building block for phosphaalkenes and phosphirenes.","Chemical communications (Cambridge, England)","2021","57","19","2356","2359","10.1039/d0cc07103j","","x-ray","1.54184","CuKα","","0.0404","0.0364","","","0.0962","0.1004","","","","","","1.037","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127933","8.5803","0.0002","10.6253","0.0002","35.5315","0.0008","93.857","0.002","95.926","0.002","110.711","0.002","2995.01","0.12","123.01","0.1","123.01","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C31 H42 N2 P2 -","- C31 H42 N2 P2 -","- C124 H168 N8 P8 -","4","2","","Hierlmeier, Gabriele; Uttendorfer, Maria K.; Wolf, Robert","Di-<i>tert</i>-butyldiphosphatetrahedrane as a building block for phosphaalkenes and phosphirenes.","Chemical communications (Cambridge, England)","2021","57","19","2356","2359","10.1039/d0cc07103j","","x-ray","1.54184","CuKα","","0.0647","0.05","","","0.1221","0.1317","","","","","","1.026","","","","has coordinates","263635","2021-04-05","13:58:42",""
"7127934","18.431","0.0012","8.6721","0.0007","20.5999","0.0013","90","","94.086","0.006","90","","3284.2","0.4","123","0.1","123","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33.85 H45.56 N2 O2 P2 -","- C34 H46 N2 O2 P2 -","- C136 H184 N8 O8 P8 -","4","1","","Hierlmeier, Gabriele; Uttendorfer, Maria K.; Wolf, Robert","Di-<i>tert</i>-butyldiphosphatetrahedrane as a building block for phosphaalkenes and phosphirenes.","Chemical communications (Cambridge, England)","2021","57","19","2356","2359","10.1039/d0cc07103j","","x-ray","1.54184","CuKα","","0.1502","0.083","","","0.1821","0.2086","","","","","","1.042","","","","has coordinates,has disorder","263635","2021-04-05","13:58:42",""
"7127935","15.7329","0.0004","8.3859","0.0002","19.9061","0.0004","90","","94.152","0.002","90","","2619.41","0.11","290","13","290","13","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H42 N4 P2 -","- C24 H42 N4 P2 -","- C96 H168 N16 P8 -","4","1","","Hierlmeier, Gabriele; Uttendorfer, Maria K.; Wolf, Robert","Di-<i>tert</i>-butyldiphosphatetrahedrane as a building block for phosphaalkenes and phosphirenes.","Chemical communications (Cambridge, England)","2021","57","19","2356","2359","10.1039/d0cc07103j","","x-ray","1.54184","CuKα","","0.0505","0.0403","","","0.1067","0.1143","","","","","","1.024","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127936","16.9144","0.0008","7.7719","0.0004","22.6944","0.001","90","","107.66","0.001","90","","2842.7","0.2","100","2","100","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C20 H17 N -","- C20 H17 N -","- C160 H136 N8 -","8","2","","Cheng, Cang; Zuo, Xiang; Tu, Dongdong; Wan, Bin; Zhang, Yanghui","Palladium-catalyzed diastereoselective cross-coupling of two aryl halides <i>via</i> C-H activation: synthesis of chiral eight-membered nitrogen heterocycles.","Chemical communications (Cambridge, England)","2021","57","23","2939","2942","10.1039/d1cc00398d","","","1.54178","CuKα","","0.0385","0.0383","","","0.1007","0.1009","","","","","","1.035","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127937","8.4284","0.0006","11.4357","0.0009","17.5925","0.0013","90","","90","","90","","1695.6","0.2","101","","101","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H15 Br2 N -","- C20 H15 Br2 N -","- C80 H60 Br8 N4 -","4","1","","Cheng, Cang; Zuo, Xiang; Tu, Dongdong; Wan, Bin; Zhang, Yanghui","Palladium-catalyzed diastereoselective cross-coupling of two aryl halides <i>via</i> C-H activation: synthesis of chiral eight-membered nitrogen heterocycles.","Chemical communications (Cambridge, England)","2021","57","23","2939","2942","10.1039/d1cc00398d","","","0.71073","MoKα","","0.0255","0.0225","","","0.048","0.049","","","","","","1.004","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127938","18.392","0.0008","12.0721","0.0005","14.3164","0.0005","90","","90.39","0.002","90","","3178.6","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H30 Cl2 N4 -","- C40 H30 Cl2 N4 -","- C160 H120 Cl8 N16 -","4","1","","Wang, Runju; Yin, Ying; Xu, Kui; Wu, Lamei; Huang, Zhengxi; Hsu, Hsien-Yi; Sessler, Jonathan L.; Zhang, Zhan","Doubly N-confused phlorin and phlorinone analogue.","Chemical communications (Cambridge, England)","2021","57","22","2772","2775","10.1039/d1cc00216c","","","0.71073","MoKα","","0.0581","0.0361","","","0.0854","0.0975","","","","","","0.998","","","","has coordinates","263618","2021-04-05","13:52:45",""
"7127939","15.3032","0.0003","16.6779","0.0003","17.5125","0.0004","64.714","0.001","73.361","0.001","77.895","0.001","3852.41","0.14","90","0.1","90","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C46 H42 Cl2 N4 O2 -","- C45.9995 H42 Cl2 N4 O2 -","- C183.998 H168 Cl8 N16 O8 -","4","2","","Wang, Runju; Yin, Ying; Xu, Kui; Wu, Lamei; Huang, Zhengxi; Hsu, Hsien-Yi; Sessler, Jonathan L.; Zhang, Zhan","Doubly N-confused phlorin and phlorinone analogue.","Chemical communications (Cambridge, England)","2021","57","22","2772","2775","10.1039/d1cc00216c","","","1.54178","CuKα","","0.0762","0.0552","","","0.1372","0.1517","","","","","","1.026","","","","has coordinates,has disorder","263618","2021-04-05","13:52:46",""
"7127940","9.259","0.002","12.501","0.003","5.7467","0.0011","90","","92.46","0.02","90","","664.5","0.2","107","2","107","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3,3-dinitrato-oxetane","3,3-dinitrato-oxetane","","- C3 H4 N2 O7 -","- C3 H4 N2 O7 -","- C12 H16 N8 O28 -","4","1","","Born, Max; Fessard, Thomas C.; Göttemann, Lucas; Klapötke, Thomas M; Stierstorfer, Jörg; Voggenreiter, Michael","3,3-Dinitratooxetane - an important leap towards energetic oxygen-rich monomers and polymers.","Chemical communications (Cambridge, England)","2021","57","22","2804","2807","10.1039/d1cc00466b","","x-ray","0.71073","MoKα","","0.1211","0.0749","","","0.1449","0.1672","","","","","","1.049","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127941","29.5695","0.0007","20.0007","0.0007","16.8654","0.0004","90","","104.018","0.002","90","","9677.3","0.5","173","2","173","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C138 H182 N24 O25 Pd4 S Si8 -","- C138 H182 N24 O25 Pd4 S Si8 -","- C276 H364 N48 O50 Pd8 S2 Si16 -","2","0.25","","Park, Seonghyeon; Kim, Dongwon; Kim, Doheon; Kim, Dongwook; Jung, Ok-Sang","A cyclic manipulation of cage isomers <i>via</i> anion exchange and thermal isomerism.","Chemical communications (Cambridge, England)","2021","57","23","2919","2922","10.1039/d0cc08303h","","","0.71073","MoKα","","0.1381","0.112","","","0.3003","0.3258","","","","","","1.076","","","","has coordinates,has disorder","263654","2021-04-05","14:03:58",""
"7127942","33.763","0.007","25.417","0.005","25.901","0.005","90","","90","","90","","22227","8","100","2","100","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C136 H176 N24 O24 Pd4 Si8 -","- C136 H176 N24.091 O24.273 Pd4 Si8 -","- C544 H704 N96.364 O97.092 Pd16 Si32 -","4","1","","Park, Seonghyeon; Kim, Dongwon; Kim, Doheon; Kim, Dongwook; Jung, Ok-Sang","A cyclic manipulation of cage isomers <i>via</i> anion exchange and thermal isomerism.","Chemical communications (Cambridge, England)","2021","57","23","2919","2922","10.1039/d0cc08303h","","","0.8","synchrotron","","0.1333","0.0732","","","0.1997","0.2309","","","","","","0.846","","","","has coordinates,has disorder","263654","2021-04-05","14:03:58",""
"7127943","18.542","0.004","22.252","0.004","27.335","0.005","89.28","0.03","79.37","0.03","68.4","0.03","10287","4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C136 H176 B8 F32 N16 Pd4 Si8 -","- C136 H176 B3 F12 N16 Pd4 Si8 -","- C272 H352 B6 F24 N32 Pd8 Si16 -","2","1","","Park, Seonghyeon; Kim, Dongwon; Kim, Doheon; Kim, Dongwook; Jung, Ok-Sang","A cyclic manipulation of cage isomers <i>via</i> anion exchange and thermal isomerism.","Chemical communications (Cambridge, England)","2021","57","23","2919","2922","10.1039/d0cc08303h","","","0.75","synchrotron","","0.2065","0.1402","","","0.3854","0.4087","","","","","","1.988","","","","has coordinates,has disorder","263654","2021-04-05","14:03:58",""
"7127944","17.968","0.004","18.783","0.004","20.866","0.004","104.55","0.03","108.76","0.03","106.52","0.03","5920","3","100","2","100","2","","","","","","","","9","P -1","-P 1","2","","","","- C146 H206 B8 F32 N16 O5 Pd4 S5 Si8 -","- C146 H206 B8 F32 N16 O5 Pd4 S5 Si8 -","- C146 H206 B8 F32 N16 O5 Pd4 S5 Si8 -","1","0.5","","Park, Seonghyeon; Kim, Dongwon; Kim, Doheon; Kim, Dongwook; Jung, Ok-Sang","A cyclic manipulation of cage isomers <i>via</i> anion exchange and thermal isomerism.","Chemical communications (Cambridge, England)","2021","57","23","2919","2922","10.1039/d0cc08303h","","","0.7","synchrotron","","0.1279","0.0906","","","0.2776","0.2966","","","","","","1.075","","","","has coordinates,has disorder","263654","2021-04-05","14:03:58",""
"7127945","33.458","0.007","17.79","0.004","35.572","0.007","90","","98.68","0.03","90","","20931","8","169","2","169","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C136 H176 Cl8 N16 O32 Pd4 Si8 -","- C136 H176 Cl6 N16 O24 Pd4 Si8 -","- C544 H704 Cl24 N64 O96 Pd16 Si32 -","4","1","","Park, Seonghyeon; Kim, Dongwon; Kim, Doheon; Kim, Dongwook; Jung, Ok-Sang","A cyclic manipulation of cage isomers <i>via</i> anion exchange and thermal isomerism.","Chemical communications (Cambridge, England)","2021","57","23","2919","2922","10.1039/d0cc08303h","","","0.8","synchrotron","","0.2251","0.0988","","","0.2539","0.2898","","","","","","1.159","","","","has coordinates,has disorder","263654","2021-04-05","14:03:58",""
"7127946","18.335","0.004","19.458","0.004","20.98","0.004","105.1","0.03","108.18","0.03","107.22","0.03","6258","4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C140 H188 Cl8 N16 O34 Pd4 S2 Si8 -","- C140 H188 Cl8 N16 O34 Pd4 S2 Si8 -","- C140 H188 Cl8 N16 O34 Pd4 S2 Si8 -","1","0.5","","Park, Seonghyeon; Kim, Dongwon; Kim, Doheon; Kim, Dongwook; Jung, Ok-Sang","A cyclic manipulation of cage isomers <i>via</i> anion exchange and thermal isomerism.","Chemical communications (Cambridge, England)","2021","57","23","2919","2922","10.1039/d0cc08303h","","","0.7","synchrotron","","0.1183","0.103","","","0.3269","0.3446","","","","","","1.395","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127947","18.26","0.004","18.337","0.004","33.391","0.007","90","","90.79","0.03","90","","11179","4","293","2","293","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C144 H200 F36 N18 O10 P6 Pd4 S4 Si8 -","- C144 H200 F36 N18 O10 P6 Pd4 S4 Si8 -","- C288 H400 F72 N36 O20 P12 Pd8 S8 Si16 -","2","0.5","","Park, Seonghyeon; Kim, Dongwon; Kim, Doheon; Kim, Dongwook; Jung, Ok-Sang","A cyclic manipulation of cage isomers <i>via</i> anion exchange and thermal isomerism.","Chemical communications (Cambridge, England)","2021","57","23","2919","2922","10.1039/d0cc08303h","","","0.7","synchrotron","","0.1741","0.0767","","","0.2048","0.2355","","","","","","0.934","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127948","18.072","0.004","18.561","0.004","18.661","0.004","117.75","0.03","116.05","0.03","91.67","0.03","4757","3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C142 H176 F18 N18 O24 Pd4 S6 Si8 -","- C142 H176 F18 N18 O24 Pd4 S6 Si8 -","- C142 H176 F18 N18 O24 Pd4 S6 Si8 -","1","0.5","","Park, Seonghyeon; Kim, Dongwon; Kim, Doheon; Kim, Dongwook; Jung, Ok-Sang","A cyclic manipulation of cage isomers <i>via</i> anion exchange and thermal isomerism.","Chemical communications (Cambridge, England)","2021","57","23","2919","2922","10.1039/d0cc08303h","","","0.65","synchrotron","","0.075","0.0674","","","0.1953","0.1998","","","","","","1.14","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127949","13.461","0.002","27.545","0.004","42.227","0.006","90","","90","","90","","15657","4","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C171 H233 N O8 S -","- C143 H165 N O4 S -","- C572 H660 N4 O16 S4 -","4","1","","Sano, Tsukasa; Masuda, Ryosuke; Sase, Shohei; Goto, Kei","Isolable small-molecule cysteine sulfenic acid.","Chemical communications (Cambridge, England)","2021","57","20","2479","2482","10.1039/d0cc08422k","","","0.71075","MoKα","","0.1403","0.0765","","","0.145","0.1705","","","","","","0.995","","","","has coordinates,has disorder","263650","2021-04-05","14:02:18",""
"7127950","10.8315","0.0007","7.1085","0.0004","27.6783","0.0018","90","","90.302","0.004","90","","2131.1","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H19 N3 O2 -","- C29 H19 N3 O2 -","- C116 H76 N12 O8 -","4","1","","Monteiro, Jorge H. S. K.; Hiti, Ethan A.; Hardy, Emily E.; Wilkinson, Grant R.; Gorden, John D.; Gorden, Anne E. V.; de Bettencourt-Dias, Ana","New up-conversion luminescence in molecular cyano-substituted naphthylsalophen lanthanide(iii) complexes.","Chemical communications (Cambridge, England)","2021","57","20","2551","2554","10.1039/d0cc08128k","","","1.54178","CuKα","","0.0949","0.0609","","","0.157","0.178","","","","","","1.051","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127951","10.3689","0.0008","18.7929","0.0018","18.9759","0.0017","107.514","0.006","95.038","0.005","104.652","0.005","3357.3","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C87 H55 Er2 N9 O8 -","- C87 H53 Er2 N9 O7 -","- C174 H106 Er4 N18 O14 -","2","1","","Monteiro, Jorge H. S. K.; Hiti, Ethan A.; Hardy, Emily E.; Wilkinson, Grant R.; Gorden, John D.; Gorden, Anne E. V.; de Bettencourt-Dias, Ana","New up-conversion luminescence in molecular cyano-substituted naphthylsalophen lanthanide(iii) complexes.","Chemical communications (Cambridge, England)","2021","57","20","2551","2554","10.1039/d0cc08128k","","","1.54178","CuKα","","0.0743","0.0521","","","0.1357","0.1499","","","","","","1.051","","","","has coordinates","263645","2021-04-05","14:01:39",""
"7127952","22.1286","0.0007","5.7699","0.0002","15.7586","0.0005","90","","106.416","0.003","90","","1930.03","0.11","93","","93","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 F N O3 S2 -","- C21 H20 F N O3 S2 -","- C84 H80 F4 N4 O12 S8 -","4","1","","Taniguchi, Ryo; Noto, Naoki; Tanaka, Seiya; Takahashi, Keigo; Sarkar, Sujan K.; Oyama, Ryoko; Abe, Manabu; Koike, Takashi; Akita, Munetaka","Simple generation of various α-monofluoroalkyl radicals by organic photoredox catalysis: modular synthesis of β-monofluoroketones.","Chemical communications (Cambridge, England)","2021","57","21","2609","2612","10.1039/d0cc08060h","","x-ray","1.54184","CuKα","","0.0363","0.0347","","","0.0953","0.0966","","","","","","1.066","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127953","26.0397","0.0016","5.8337","0.0003","7.1864","0.0005","90","","95.629","0.006","90","","1086.41","0.12","93","","93","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 F O3 -","- C12 H13 F O3 -","- C48 H52 F4 O12 -","4","1","","Taniguchi, Ryo; Noto, Naoki; Tanaka, Seiya; Takahashi, Keigo; Sarkar, Sujan K.; Oyama, Ryoko; Abe, Manabu; Koike, Takashi; Akita, Munetaka","Simple generation of various α-monofluoroalkyl radicals by organic photoredox catalysis: modular synthesis of β-monofluoroketones.","Chemical communications (Cambridge, England)","2021","57","21","2609","2612","10.1039/d0cc08060h","","x-ray","1.54184","CuKα","","0.0971","0.0885","","","0.2101","0.2156","","","","","","1.158","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127954","17.06","0.002","10.1206","0.0008","19.139","0.002","90","","98.606","0.011","90","","3267.3","0.6","93","","93","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C42 H42 N2 -","- C42 H42 N2 -","- C168 H168 N8 -","4","1","","Taniguchi, Ryo; Noto, Naoki; Tanaka, Seiya; Takahashi, Keigo; Sarkar, Sujan K.; Oyama, Ryoko; Abe, Manabu; Koike, Takashi; Akita, Munetaka","Simple generation of various α-monofluoroalkyl radicals by organic photoredox catalysis: modular synthesis of β-monofluoroketones.","Chemical communications (Cambridge, England)","2021","57","21","2609","2612","10.1039/d0cc08060h","","x-ray","1.54184","CuKα","","0.1681","0.0958","","","0.2462","0.2998","","","","","","1.024","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127955","15.5254","0.0002","5.7261","0.0001","34.5954","0.0005","90","","90","","90","","3075.53","0.08","93","","93","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C15 H16 F N O3 S2 -","- C15 H16 F N O3 S2 -","- C120 H128 F8 N8 O24 S16 -","8","2","","Taniguchi, Ryo; Noto, Naoki; Tanaka, Seiya; Takahashi, Keigo; Sarkar, Sujan K.; Oyama, Ryoko; Abe, Manabu; Koike, Takashi; Akita, Munetaka","Simple generation of various α-monofluoroalkyl radicals by organic photoredox catalysis: modular synthesis of β-monofluoroketones.","Chemical communications (Cambridge, England)","2021","57","21","2609","2612","10.1039/d0cc08060h","","x-ray","1.54184","CuKα","","0.0307","0.0303","","","0.0842","0.0845","","","","","","1.082","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127956","11.329","0.005","12.521","0.006","32.774","0.015","90","","91.641","0.005","90","","4647","4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H54 N0 Ni3 S6 -","- C48 H54 Ni3 S6 -","- C192 H216 Ni12 S24 -","4","1","","Maman, Manju P.; Nath, Akashdeep; Anjusree S, ?; Das, Bikas C.; Mandal, Sukhendu","Reversible polymorphic structural transition of crown-like nickel nanoclusters and its effect on conductivity.","Chemical communications (Cambridge, England)","2021","57","23","2935","2938","10.1039/d1cc00402f","","","0.71073","MoKα","","0.1924","0.1093","","","0.2651","0.3115","","","","","","1.167","","","","has coordinates","263656","2021-04-05","14:04:21",""
"7127957","17.295","0.016","10.63","0.01","25.8","0.02","90","","99.43","0.03","90","","4679","7","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H54 N0 Ni3 S6 -","- C48 H54 Ni3 S6 -","- C192 H216 Ni12 S24 -","4","1","","Maman, Manju P.; Nath, Akashdeep; Anjusree S, ?; Das, Bikas C.; Mandal, Sukhendu","Reversible polymorphic structural transition of crown-like nickel nanoclusters and its effect on conductivity.","Chemical communications (Cambridge, England)","2021","57","23","2935","2938","10.1039/d1cc00402f","","","0.71073","MoKα","","0.1683","0.0691","","","0.1483","0.2055","","","","","","0.948","","","","has coordinates","263656","2021-04-05","14:04:21",""
"7127958","18.542","0.0009","14.0911","0.0007","8.2672","0.0004","90","","90","","90","","2160.03","0.18","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C12 H22 F6 Fe N2 O6 S4 -","- C12 H22 F6 Fe N2 O6 S4 -","- C48 H88 F24 Fe4 N8 O24 S16 -","4","1","","Deutscher, Jennifer; Gerschel, Philipp; Warm, Katrin; Kuhlmann, Uwe; Mebs, Stefan; Haumann, Michael; Dau, Holger; Hildebrandt, Peter; Apfel, Ulf-Peter; Ray, Kallol","A bioinspired oxoiron(IV) motif supported on a N<sub>2</sub>S<sub>2</sub> macrocyclic ligand.","Chemical communications (Cambridge, England)","2021","57","23","2947","2950","10.1039/d1cc00250c","","","0.71073","MoKα","","0.0506","0.0341","","","0.0591","0.0641","","","","","","1.047","","","","has coordinates","263657","2021-04-05","14:04:29",""
"7127959","8.5286","0.0007","8.8855","0.0007","9.7499","0.0008","96.876","0.004","90.559","0.003","113.841","0.003","669.57","0.1","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H28 F6 Fe N4 O6 S4 -","- C16 H28 F6 Fe N4 O6 S4 -","- C16 H28 F6 Fe N4 O6 S4 -","1","0.5","","Deutscher, Jennifer; Gerschel, Philipp; Warm, Katrin; Kuhlmann, Uwe; Mebs, Stefan; Haumann, Michael; Dau, Holger; Hildebrandt, Peter; Apfel, Ulf-Peter; Ray, Kallol","A bioinspired oxoiron(IV) motif supported on a N<sub>2</sub>S<sub>2</sub> macrocyclic ligand.","Chemical communications (Cambridge, England)","2021","57","23","2947","2950","10.1039/d1cc00250c","","","0.71073","MoKα","","0.0346","0.0289","","","0.0615","0.0641","","","","","","1.083","","","","has coordinates","263657","2021-04-05","14:04:30",""
"7127960","25.0072","0.0012","25.0072","0.0012","55.114","0.002","90","","90","","120","","29849","2","298.3","1","298.3","1","","","","","","","","6","R -3 :H","-R 3","148","","","","- C309 H276 Cl32 Mn40 N150 O33 -","- C309 H276 Cl32 Mn40 N150 O33 -","- C927 H828 Cl96 Mn120 N450 O99 -","3","0.166667","","Wu, Tai-Xue; Tao, Ye; He, Qiu-Ju; Li, Hai-Ye; Bian, He-Dong; Huang, Fu-Ping","Constructing an unprecedented {Mn<sup>II</sup><sub>38</sub>} matryoshka doll with a [Mn<sub>18</sub>(CO<sub>3</sub>)<sub>9</sub>] inorganic core and magnetocaloric effect.","Chemical communications (Cambridge, England)","2021","57","22","2732","2735","10.1039/d0cc07884k","","x-ray","1.54184","CuKα","","0.1854","0.1009","","","0.2738","0.3433","","","","","","1.027","","","","has coordinates,has disorder","263620","2021-04-05","13:53:23",""
"7127961","14.7652","0.0008","15.0291","0.0008","16.2398","0.0007","71.439","0.005","73.953","0.004","71.422","0.005","3176.3","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C104 H92 Cu4 N12 O20 -","- C104 H92 Cu4 N12 O20 -","- C104 H92 Cu4 N12 O20 -","1","0.5","","Markwell-Heys, Adrian W; Schneider, Matthew L.; Madridejos, Jenica Marie L.; Metha, Gregory F.; Bloch, Witold M.","Self-sorting of porous Cu<sub>4</sub>L<sub>2</sub>L'<sub>2</sub> metal-organic cages composed of isomerisable ligands.","Chemical communications (Cambridge, England)","2021","57","23","2915","2918","10.1039/d0cc08076d","","","0.71073","MoKα","","0.0756","0.0442","","","0.0935","0.1039","","","","","","0.977","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127962","10.959","0.002","14.077","0.003","19.406","0.004","106.27","0.03","91.83","0.03","101.78","0.03","2800.7","1.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C100 H84 Cu4 N12 O20 -","- C100 H84 Cu4 N12 O20 -","- C100 H84 Cu4 N12 O20 -","1","0.5","","Markwell-Heys, Adrian W; Schneider, Matthew L.; Madridejos, Jenica Marie L.; Metha, Gregory F.; Bloch, Witold M.","Self-sorting of porous Cu<sub>4</sub>L<sub>2</sub>L'<sub>2</sub> metal-organic cages composed of isomerisable ligands.","Chemical communications (Cambridge, England)","2021","57","23","2915","2918","10.1039/d0cc08076d","","","0.71073","Synchrotron","","0.0375","0.034","","","0.0954","0.0979","","","","","","1.039","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127963","13.937","0.003","14.389","0.003","15.592","0.003","111.23","0.03","102.1","0.03","91.91","0.03","2829.3","1.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C90 H62 Cu4 N8 O20 -","- C90 H62 Cu4 N8 O20 -","- C90 H62 Cu4 N8 O20 -","1","0.5","","Markwell-Heys, Adrian W; Schneider, Matthew L.; Madridejos, Jenica Marie L.; Metha, Gregory F.; Bloch, Witold M.","Self-sorting of porous Cu<sub>4</sub>L<sub>2</sub>L'<sub>2</sub> metal-organic cages composed of isomerisable ligands.","Chemical communications (Cambridge, England)","2021","57","23","2915","2918","10.1039/d0cc08076d","","","0.71073","Synchrotron","","0.0692","0.0603","","","0.1832","0.1916","","","","","","1.054","","","","has coordinates","263653","2021-04-05","14:03:07",""
"7127964","14.027","0.003","14.475","0.003","15.468","0.003","111.87","0.03","101.96","0.03","92.36","0.03","2827","1.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C104 H92 Cu4 N12 O20 -","- C104 H92 Cu4 N12 O20 -","- C104 H92 Cu4 N12 O20 -","1","0.5","","Markwell-Heys, Adrian W; Schneider, Matthew L.; Madridejos, Jenica Marie L.; Metha, Gregory F.; Bloch, Witold M.","Self-sorting of porous Cu<sub>4</sub>L<sub>2</sub>L'<sub>2</sub> metal-organic cages composed of isomerisable ligands.","Chemical communications (Cambridge, England)","2021","57","23","2915","2918","10.1039/d0cc08076d","","","0.71073","Synchrotron","","0.0493","0.0436","","","0.1304","0.1358","","","","","","1.027","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127965","10.994","0.002","16.101","0.003","21.413","0.004","96.75","0.03","99.9","0.03","92","0.03","3702.2","1.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C79 H63 Cu2 N11 O8 -","- C79 H63 Cu2 N11 O8 -","- C158 H126 Cu4 N22 O16 -","2","1","","Markwell-Heys, Adrian W; Schneider, Matthew L.; Madridejos, Jenica Marie L.; Metha, Gregory F.; Bloch, Witold M.","Self-sorting of porous Cu<sub>4</sub>L<sub>2</sub>L'<sub>2</sub> metal-organic cages composed of isomerisable ligands.","Chemical communications (Cambridge, England)","2021","57","23","2915","2918","10.1039/d0cc08076d","","","0.71073","Synchrotron","","0.0485","0.044","","","0.125","0.1296","","","","","","1.039","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127966","14.682","0.003","15.055","0.003","16.11","0.003","70.99","0.03","74.36","0.03","71.24","0.03","3133.3","1.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C106 H84 Cu4 N12 O18 -","- C106 H84 Cu4 N12 O18 -","- C106 H84 Cu4 N12 O18 -","1","0.5","","Markwell-Heys, Adrian W; Schneider, Matthew L.; Madridejos, Jenica Marie L.; Metha, Gregory F.; Bloch, Witold M.","Self-sorting of porous Cu<sub>4</sub>L<sub>2</sub>L'<sub>2</sub> metal-organic cages composed of isomerisable ligands.","Chemical communications (Cambridge, England)","2021","57","23","2915","2918","10.1039/d0cc08076d","","","0.71073","Synchrotron","","0.0599","0.0518","","","0.1527","0.1614","","","","","","1.025","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127967","11.9844","0.0004","13.1181","0.0004","17.6206","0.0006","98.615","0.002","98.07","0.002","104.748","0.002","2602.12","0.15","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","{(MeSiP2)Co}2(N2)","","- C50 H78 Co2 N2 P4 Si2 -","- C50 H78 Co2 N2 P4 Si2 -","- C100 H156 Co4 N4 P8 Si4 -","2","1","","So, Jongho; Kim, Seji; Cho, Kyung-Bin; Lee, Yunho","Metal-ligand cooperative transformation of alkyl azide to isocyanate occurring at a Co-Si moiety.","Chemical communications (Cambridge, England)","2021","57","26","3219","3222","10.1039/d0cc08012h","","","0.71073","MoKα","","0.0614","0.0369","","","0.0872","0.0964","","","","","","1.015","","","","has coordinates","263630","2021-04-05","13:56:27",""
"7127968","10.618","0.002","19.666","0.004","18.29","0.003","90","","106.87","","90","","3654.8","1.2","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(MeSiP2)Co(CNtBu)2","","- C35 H57 Co N2 P2 Si -","- C35 H57 Co N2 P2 Si -","- C140 H228 Co4 N8 P8 Si4 -","4","1","","So, Jongho; Kim, Seji; Cho, Kyung-Bin; Lee, Yunho","Metal-ligand cooperative transformation of alkyl azide to isocyanate occurring at a Co-Si moiety.","Chemical communications (Cambridge, England)","2021","57","26","3219","3222","10.1039/d0cc08012h","","","0.71073","MoKα","","0.0562","0.0406","","","0.1018","0.1084","","","","","","1.004","","","","has coordinates,has disorder","263630","2021-04-05","13:56:34",""
"7127969","20.4843","0.0014","11.8547","0.0009","14.178","0.001","90","","90","","90","","3442.9","0.4","120","2","120","2","","","","","","","","7","P n a 21","P 2c -2n","33","","(MeSiNAdP2)Co(CO)","","- C36 H54 Co N O P2 Si -","- C36 H54 Co N O P2 Si -","- C144 H216 Co4 N4 O4 P8 Si4 -","4","1","","So, Jongho; Kim, Seji; Cho, Kyung-Bin; Lee, Yunho","Metal-ligand cooperative transformation of alkyl azide to isocyanate occurring at a Co-Si moiety.","Chemical communications (Cambridge, England)","2021","57","26","3219","3222","10.1039/d0cc08012h","","","0.71073","MoKα","","0.0658","0.053","","","0.132","0.1397","","","","","","1.024","","","","has coordinates","263630","2021-04-05","13:56:45",""
"7127970","36.6282","0.0018","10.3484","0.0005","16.3466","0.0008","90","","90","","90","","6196.1","0.5","120","2","120","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","(MeSiP2)Co(CO)(PMe3)","","- C29 H48 Co O P3 Si -","- C29 H48 Co O P3 Si -","- C232 H384 Co8 O8 P24 Si8 -","8","1","","So, Jongho; Kim, Seji; Cho, Kyung-Bin; Lee, Yunho","Metal-ligand cooperative transformation of alkyl azide to isocyanate occurring at a Co-Si moiety.","Chemical communications (Cambridge, England)","2021","57","26","3219","3222","10.1039/d0cc08012h","","","0.71073","MoKα","","0.0993","0.0565","","","0.1487","0.1849","","","","","","0.802","","","","has coordinates","263630","2021-04-05","13:56:45",""
"7127971","10.971","0.002","12.496","0.002","14.51","0.003","81.037","0.009","86.84","0.009","85.14","0.009","1956.1","0.6","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C84 H124 Co2 N4 P4 Si2 -","- C84 H124 Co2 N4 P4 Si2 -","- C84 H124 Co2 N4 P4 Si2 -","1","0.5","","So, Jongho; Kim, Seji; Cho, Kyung-Bin; Lee, Yunho","Metal-ligand cooperative transformation of alkyl azide to isocyanate occurring at a Co-Si moiety.","Chemical communications (Cambridge, England)","2021","57","26","3219","3222","10.1039/d0cc08012h","","","0.71073","MoKα","","0.0531","0.04","","","0.117","0.1335","","","","","","0.745","","","","has coordinates","263630","2021-04-05","13:56:45",""
"7127972","11.2544","0.0006","15.4033","0.0008","15.7698","0.0008","90","","94.781","0.001","90","","2724.3","0.2","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(MeSiP2)Co(CO)2","","- C27 H39 Co O2 P2 Si -","- C27 H39 Co O2 P2 Si -","- C108 H156 Co4 O8 P8 Si4 -","4","1","","So, Jongho; Kim, Seji; Cho, Kyung-Bin; Lee, Yunho","Metal-ligand cooperative transformation of alkyl azide to isocyanate occurring at a Co-Si moiety.","Chemical communications (Cambridge, England)","2021","57","26","3219","3222","10.1039/d0cc08012h","","","0.71073","MoKα","","0.059","0.0339","","","0.0856","0.0992","","","","","","1.06","","","","has coordinates","263630","2021-04-05","13:56:45",""
"7127973","36.682","0.007","10.328","0.002","16.385","0.003","90","","90","","90","","6207","2","120","2","120","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","(MeSiP2)Co(N2)(PMe3)","","- C28 H48 Co N2 P3 Si -","- C28 H48 Co N2 P3 Si -","- C224 H384 Co8 N16 P24 Si8 -","8","1","","So, Jongho; Kim, Seji; Cho, Kyung-Bin; Lee, Yunho","Metal-ligand cooperative transformation of alkyl azide to isocyanate occurring at a Co-Si moiety.","Chemical communications (Cambridge, England)","2021","57","26","3219","3222","10.1039/d0cc08012h","","","0.71073","MoKα","","0.0405","0.0356","","","0.0802","0.0831","","","","","","1.128","","","","has coordinates,has disorder","263630","2021-04-05","13:56:45",""
"7127974","11.6578","0.0003","12.4438","0.0003","13.0555","0.0004","63.465","0.003","72.555","0.002","65.144","0.003","1522.76","0.09","149.99","0.1","149.99","0.1","","","","","","","","4","P -1","-P 1","2","XHY-1","XHY-1","","- C36 H40 N2 O2 -","- C36 H40 N2 O2 -","- C72 H80 N4 O4 -","2","1","","Xu, Houyang; Lin, Meng-Di; Yuan, Jun; Zhou, Baiyang; Mu, Yingxiao; Huo, Yanping; Zhu, Kelong","Fluorescence emission enhancement of a T-shaped benzimidazole with a mechanically-interlocked 'suit'.","Chemical communications (Cambridge, England)","2021","57","26","3239","3242","10.1039/d0cc07471c","","x-ray","1.54184","CuKα","","0.0459","0.041","","","0.1133","0.118","","","","","","1.056","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127975","15.4345","0.0008","27.2605","0.0016","18.41","0.0011","90","","115.234","0.002","90","","7006.9","0.7","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","suitane","suitane","","- C30 H20 B F4 N2 O12 -","- C274.552 H289.884 B4 F16 N8 O44 -","- C274.552 H289.884 B4 F16 N8 O44 -","1","0.25","","Xu, Houyang; Lin, Meng-Di; Yuan, Jun; Zhou, Baiyang; Mu, Yingxiao; Huo, Yanping; Zhu, Kelong","Fluorescence emission enhancement of a T-shaped benzimidazole with a mechanically-interlocked 'suit'.","Chemical communications (Cambridge, England)","2021","57","26","3239","3242","10.1039/d0cc07471c","","","1.34138","GaKα","","0.1087","0.0891","","","0.2639","0.2832","","","","","","1.027","","","","has coordinates,has disorder","263632","2021-04-05","13:57:33",""
"7127976","22.092","0.003","20.054","0.003","42.684","0.006","90","","97.443","0.005","90","","18751","5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C98 H83 F24 N9 P4 -","- C94 H77 F24 N7 P4 -","- C752 H616 F192 N56 P32 -","8","2","","Zhang, Haiyang; Cheng, Lin; Nian, Hao; Du, Jiang; Chen, Tao; Cao, Liping","Adaptive chirality of achiral tetraphenylethene-based tetracationic cyclophanes with dual responses of fluorescence and circular dichroism in water.","Chemical communications (Cambridge, England)","2021","57","25","3135","3138","10.1039/d1cc00303h","","","1.34139","GaKα","","0.0948","0.0832","","","0.2445","0.2641","","","","","","1.026","","","","has coordinates,has disorder","263641","2021-04-05","14:00:40",""
"7127977","9.6728","0.0006","6.3539","0.0003","11.8458","0.0006","90","","101.244","0.006","90","","714.07","0.07","295","","295","","","","","","","","","5","P 1 c 1","P -2yc","7","","5-methyl-2-phenyl-4-(phenylthio)-1,2-dihydro-3H-pyrazol-3-one","","- C16 H14 N2 O S -","- C16 H14 N2 O S -","- C32 H28 N4 O2 S2 -","2","1","","Yuan, Yong; Li, Liang-Sen; Zhang, Lin; Wang, Feng; Jiang, Lin; Zuo, Lin; Wang, Qi; Hu, Jian-Guo; Lei, Aiwen","Electrochemical synthesis of versatile ammonium oxides under metal catalyst-, exogenous-oxidant-, and exogenous-electrolyte-free conditions.","Chemical communications (Cambridge, England)","2021","57","22","2768","2771","10.1039/d1cc00486g","","x-ray","0.71073","MoKα","","0.0338","0.0322","","","0.0744","0.0761","","","","","","1.066","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127978","17.55","0.004","17.234","0.003","24.922","0.005","90","","106.01","0.03","90","","7245","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H53 Gd N4 Na O20.5 -","- C23 H44 Gd N4 Na O20.5 -","- C184 H352 Gd8 N32 Na8 O164 -","8","2","","Baroni, Simona; Carnovale, Irene Maria; Carrera, Carla; Boccalon, Mariangela; Guidolin, Nicol; Demitri, Nicola; Lattuada, Luciano; Tedoldi, Fabio; Baranyai, Zsolt; Aime, Silvio","H-Bonding and intramolecular catalysis of proton exchange affect the CEST properties of Eu<sup>III</sup> complexes with HP-DO3A-like ligands.","Chemical communications (Cambridge, England)","2021","57","26","3287","3290","10.1039/d1cc00366f","","","0.7","Synchrotron","","0.0283","0.0275","","","0.0754","0.0756","","","","","","1.042","","","","has coordinates,has disorder","263633","2021-04-05","13:57:52",""
"7127979","18.237","0.004","17.179","0.003","23.059","0.005","90","","107.97","0.03","90","","6872","3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H48 Gd N5 O15 -","- C22 H34 Gd N5 O12.125 -","- C176 H272 Gd8 N40 O97 -","8","2","","Baroni, Simona; Carnovale, Irene Maria; Carrera, Carla; Boccalon, Mariangela; Guidolin, Nicol; Demitri, Nicola; Lattuada, Luciano; Tedoldi, Fabio; Baranyai, Zsolt; Aime, Silvio","H-Bonding and intramolecular catalysis of proton exchange affect the CEST properties of Eu<sup>III</sup> complexes with HP-DO3A-like ligands.","Chemical communications (Cambridge, England)","2021","57","26","3287","3290","10.1039/d1cc00366f","","","0.62","Synchrotron","","0.0918","0.0626","","","0.1849","0.2079","","","","","","1.039","","","","has coordinates,has disorder","263633","2021-04-05","13:57:57",""
"7127980","5.3407","0.0011","12.745","0.003","18.872","0.004","90","","92.51","0.03","90","","1283.3","0.5","113","2","113","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H22 N2 O4 -","- C27 H22 N2 O4 -","- C54 H44 N4 O8 -","2","1","","Cui, Yanhui; Li, Fen; Zhang, Xin","Controlling fluorescence resonance energy transfer of donor-acceptor dyes by Diels-Alder dynamic covalent bonds.","Chemical communications (Cambridge, England)","2021","57","26","3275","3278","10.1039/d1cc00165e","","","0.71073","MoKα","","0.0915","0.0709","","","0.1819","0.1968","","","","","","1.04","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127981","11.246","0.016","11.153","0.016","20.85","0.03","90","","92.47","0.02","90","","2613","6","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H36 B N O2 -","- C29 H36 B N O2 -","- C116 H144 B4 N4 O8 -","4","1","","Qiu, Xianfan; Xu, Liugen; Wang, Shuxia; Dai, Ying; Feng, Yunqiu; Gong, Chang; Tao, Chuanzhou","Copper-catalyzed borylative aminomethylation of C-C double and triple bonds with N,O-acetal.","Chemical communications (Cambridge, England)","2021","57","26","3279","3282","10.1039/d1cc00093d","","","0.71073","MoKα","","0.0858","0.055","","","0.1738","0.1986","","","","","","1.067","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127982","17.7569","0.0006","23.7286","0.0009","17.7374","0.0007","90","","101.795","0.002","90","","7315.8","0.5","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C72 H102 P2 Pd -","- C72 H102 P2 Pd -","- C288 H408 P8 Pd4 -","4","0.5","","Martín, M Trinidad; Marín, Mario; Rama, Raquel J.; Álvarez, Eleuterio; Maya, Celia; Molina, Francisco; Nicasio, M. Carmen","Zero-valent ML<sub>2</sub> complexes of group 10 metals supported by terphenyl phosphanes.","Chemical communications (Cambridge, England)","2021","57","25","3083","3086","10.1039/d1cc00676b","","","0.71073","MoKα","","0.057","0.0482","","","0.1432","0.1515","","","","","","0.858","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127983","10.7226","0.0008","11.7463","0.0009","13.7443","0.0011","73.245","0.004","75.828","0.004","69.982","0.003","1536.8","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H38 Ni P2 -","- C40 H38 Ni P2 -","- C80 H76 Ni2 P4 -","2","1","","Martín, M Trinidad; Marín, Mario; Rama, Raquel J.; Álvarez, Eleuterio; Maya, Celia; Molina, Francisco; Nicasio, M. Carmen","Zero-valent ML<sub>2</sub> complexes of group 10 metals supported by terphenyl phosphanes.","Chemical communications (Cambridge, England)","2021","57","25","3083","3086","10.1039/d1cc00676b","","","0.56086","AgKα","","0.069","0.0432","","","0.1211","0.1435","","","","","","0.883","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127984","23.3099","0.001","16.9037","0.0007","18.5008","0.0008","90","","90","","90","","7289.8","0.5","193","2","193","2","","","","","","","","4","I b a 2","I 2 -2c","45","","","","- C72 H102 Ni P2 -","- C72 H102 Ni P2 -","- C288 H408 Ni4 P8 -","4","0.5","","Martín, M Trinidad; Marín, Mario; Rama, Raquel J.; Álvarez, Eleuterio; Maya, Celia; Molina, Francisco; Nicasio, M. Carmen","Zero-valent ML<sub>2</sub> complexes of group 10 metals supported by terphenyl phosphanes.","Chemical communications (Cambridge, England)","2021","57","25","3083","3086","10.1039/d1cc00676b","","","0.71073","MoKα","","0.0623","0.0518","","","0.1326","0.1384","","","","","","1.052","","","","has coordinates,has disorder","301860","2025-08-22","09:26:57",""
"7127985","9.8419","0.0006","12.7335","0.0007","19.002","0.0012","104.668","0.002","99.269","0.002","92.692","0.002","2264.1","0.2","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C49 H77 Ni P -","- C49 H77 Ni P -","- C98 H154 Ni2 P2 -","2","1","","Martín, M Trinidad; Marín, Mario; Rama, Raquel J.; Álvarez, Eleuterio; Maya, Celia; Molina, Francisco; Nicasio, M. Carmen","Zero-valent ML<sub>2</sub> complexes of group 10 metals supported by terphenyl phosphanes.","Chemical communications (Cambridge, England)","2021","57","25","3083","3086","10.1039/d1cc00676b","","","0.71073","MoKα","","0.06","0.0511","","","0.1431","0.1499","","","","","","1.057","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127986","17.6217","0.0014","23.6025","0.0018","17.6699","0.0014","90","","101.514","0.003","90","","7201.3","1","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C77 H114 P2 Pt -","- C77 H114 P2 Pt -","- C308 H456 P8 Pt4 -","4","0.5","","Martín, M Trinidad; Marín, Mario; Rama, Raquel J.; Álvarez, Eleuterio; Maya, Celia; Molina, Francisco; Nicasio, M. Carmen","Zero-valent ML<sub>2</sub> complexes of group 10 metals supported by terphenyl phosphanes.","Chemical communications (Cambridge, England)","2021","57","25","3083","3086","10.1039/d1cc00676b","","","0.71073","MoKα","","0.0453","0.0348","","","0.0836","0.0906","","","","","","1.043","","","","has coordinates,has disorder","263640","2021-04-05","14:00:26",""
"7127987","9.1461","0.0003","9.681","0.0003","11.8702","0.0003","90","","90","","90","","1051.03","0.05","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H13 P S -","- C10 H13 P S -","- C40 H52 P4 S4 -","4","1","","Xu, Ronghua; Gao, Zhenhua; Yu, Yiteng; Tang, Yehua; Tian, Duanshuai; Chen, Tian; Chen, Yibing; Xu, Guangqing; Shi, Enxue; Tang, Wenjun","A facile and practical preparation of P-chiral phosphine oxides.","Chemical communications (Cambridge, England)","2021","57","27","3335","3338","10.1039/d1cc00646k","","","0.71073","MoKα","","0.0247","0.0238","","","0.0656","0.0668","","","","","","1.054","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127988","32.8416","0.0015","32.8416","0.0015","9.779","0.0005","90","","90","","120","","9134.3","0.8","193","2","193","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C21 H17 Cl N2 O6 -","- C21 H17 Cl N2 O6 -","- C378 H306 Cl18 N36 O108 -","18","1","","Duan, Jindian; Mao, Yiyang; Xian, Anmei; Rong, Binsen; Xu, Gaochen; Li, Zhenjiang; Zhao, Lili; Zhu, Ning; Guo, Kai","Copper-catalyzed regioselective [3+2] annulation of malonate-tethered acyl oximes with isatins.","Chemical communications (Cambridge, England)","2021","57","27","3379","3382","10.1039/d0cc07995b","","","0.71073","MoKα","","0.0759","0.051","","","0.1348","0.1552","","","","","","1.017","","","","has coordinates","301860","2025-08-22","09:26:57",""
"7127989","16.395","0.003","17.287","0.004","17.363","0.004","90","","90","","90","","4921","1.8","300","2","300","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C28 H26 O9 -","- C28 H26 O9 -","- C224 H208 O72 -","8","2","","Tan, Qingfa; Yu, Han; Luo, Yao; Chang, Fenzhen; Liu, Xiaohua; Zhou, Yuqiao; Feng, Xiaoming","Asymmetric catalytic [4+3] cycloaddition of ortho-quinone methides with oxiranes.","Chemical communications (Cambridge, England)","2021","57","24","3018","3021","10.1039/d1cc00262g","","","1.54178","CuKα","","0.0372","0.0338","","","0.0935","0.0976","","","","","","1.02","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7127990","28.1257","0.0008","28.1257","0.0008","8.102","0.0003","90","","90","","120","","5550.5","0.3","144","2","144","2","","","","","","","","3","R 3 :H","R 3","146","","","","- C28 H26 O9 -","- C28 H26 O9 -","- C252 H234 O81 -","9","1","","Tan, Qingfa; Yu, Han; Luo, Yao; Chang, Fenzhen; Liu, Xiaohua; Zhou, Yuqiao; Feng, Xiaoming","Asymmetric catalytic [4+3] cycloaddition of ortho-quinone methides with oxiranes.","Chemical communications (Cambridge, England)","2021","57","24","3018","3021","10.1039/d1cc00262g","","","1.54178","CuKα","","0.1051","0.0972","","","0.2163","0.231","","","","","","1.213","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7127991","9.34","0.003","9.34","0.003","9.71","0.005","90","","90","","120","","733.6","0.5","293","2","293","2","","","","","","","","6","P 3 1 m","P 3 -2","157","","","","- Ba3 Bi6 F11 Li O21 Se7 -","- Ba3 Bi6 F11 Li O21 Se7 -","- Ba3 Bi6 F11 Li O21 Se7 -","1","0.166667","","Shi, Shuangshuang; Lin, Chensheng; Zhao, Dan; Luo, Min; Cao, Liling; Peng, Guang; Ye, Ning","Unexpected aliovalent cation substitution between two NLO materials LiBa<sub>3</sub>Bi<sub>6</sub>(SeO<sub>3</sub>)<sub>7</sub>F<sub>11</sub> and Ba<sub>3</sub>Bi<sub>6.5</sub>(SeO<sub>3</sub>)<sub>7</sub>F<sub>10.5</sub>O<sub>0.5</sub>.","Chemical communications (Cambridge, England)","2021","57","24","2982","2985","10.1039/d1cc00346a","","","0.71073","MoKα","","0.0269","0.0256","","","0.0477","0.0481","","","","","","0.879","","","","has coordinates","263617","2021-04-05","13:52:34",""
"7127992","9.479","0.003","9.479","0.003","9.566","0.004","90","","90","","120","","744.4","0.5","296","2","296","2","","","","","","","","5","P 3 1 m","P 3 -2","157","","","","- Ba3 Bi6.5 F10.5 O21.5 Se7 -","- Ba3 Bi6.5001 F10.5 O21.5 Se7 -","- Ba3 Bi6.5001 F10.5 O21.5 Se7 -","1","0.166667","","Shi, Shuangshuang; Lin, Chensheng; Zhao, Dan; Luo, Min; Cao, Liling; Peng, Guang; Ye, Ning","Unexpected aliovalent cation substitution between two NLO materials LiBa<sub>3</sub>Bi<sub>6</sub>(SeO<sub>3</sub>)<sub>7</sub>F<sub>11</sub> and Ba<sub>3</sub>Bi<sub>6.5</sub>(SeO<sub>3</sub>)<sub>7</sub>F<sub>10.5</sub>O<sub>0.5</sub>.","Chemical communications (Cambridge, England)","2021","57","24","2982","2985","10.1039/d1cc00346a","","","0.71073","MoKα","","0.0326","0.0312","","","0.0646","0.065","","","","","","1.13","","","","has coordinates","263617","2021-04-05","13:52:34",""
"7127993","5.7216","0.0001","15.4964","0.0001","17.3718","0.0001","90","","90","","90","","1540.26","0.03","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","methyl (R,E)-5-phenyl-6-(pyridin-2-yl)hex-2-enoate","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C72 H76 N4 O8 -","4","1","","Frankowski, Sebastian; Kowalska, Justyna; Albrecht, Anna","Pyridylacetic acids and related systems as alkylheteroarene surrogates in asymmetric decarboxylative Michael addition.","Chemical communications (Cambridge, England)","2021","57","27","3387","3390","10.1039/d0cc08182e","","x-ray","1.54184","CuKα","","0.0219","0.0217","","","0.054","0.0541","","","","","","1.067","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7127994","10.8194","0.0004","12.5965","0.0006","15.1388","0.0006","106.563","0.004","98.875","0.003","113.707","0.004","1723.64","0.16","123","1","123.15","","","","","","","","","6","P -1","-P 1","2","","","","- C33 H53 Fe N4 O2 P -","- C33 H53 Fe N4 O2 P -","- C66 H106 Fe2 N8 O4 P2 -","2","1","","Reichl, Stephan; Grünbauer, Rebecca; Balázs, Gábor; Scheer, Manfred","Reactivity of P<sub>4</sub> butterfly complexes towards NHCs - generation of a metal-bridged P<sub>2</sub> dumbbell complex.","Chemical communications (Cambridge, England)","2021","57","27","3383","3386","10.1039/d1cc00615k","","","1.54184","CuKα","","0.0363","0.0339","","","0.0871","0.0887","","","","","","1.03","","","","has coordinates","263627","2021-04-05","13:55:21",""
"7127995","13.7995","0.0002","22.0551","0.0003","16.5807","0.0002","90","","99.549","0.001","90","","4976.4","0.12","123.01","0.1","123.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H82 Fe2 N4 P4 -","- C48 H82 Fe2 N4 P4 -","- C192 H328 Fe8 N16 P16 -","4","1","","Reichl, Stephan; Grünbauer, Rebecca; Balázs, Gábor; Scheer, Manfred","Reactivity of P<sub>4</sub> butterfly complexes towards NHCs - generation of a metal-bridged P<sub>2</sub> dumbbell complex.","Chemical communications (Cambridge, England)","2021","57","27","3383","3386","10.1039/d1cc00615k","","","1.54184","CuKα","","0.052","0.0488","","","0.1203","0.1239","","","","","","1.063","","","","has coordinates,has disorder","263627","2021-04-05","13:55:22",""
"7127996","14.7956","0.0003","8.60807","0.00016","32.9425","0.0006","90","","97.7244","0.0016","90","","4157.54","0.14","123","0.16","123","0.16","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H54 Cr2 N4 O5 P2 -","- C39 H54 Cr2 N4 O5 P2 -","- C156 H216 Cr8 N16 O20 P8 -","4","1","","Reichl, Stephan; Grünbauer, Rebecca; Balázs, Gábor; Scheer, Manfred","Reactivity of P<sub>4</sub> butterfly complexes towards NHCs - generation of a metal-bridged P<sub>2</sub> dumbbell complex.","Chemical communications (Cambridge, England)","2021","57","27","3383","3386","10.1039/d1cc00615k","","x-ray","1.54184","CuKα","","0.0548","0.0456","","","0.118","0.1261","","","","","","1.04","","","","has coordinates,has disorder","263627","2021-04-05","13:55:22",""
"7127997","9.171","0.0001","10.0901","0.0003","13.7727","0.0003","109.378","0.001","91.575","0.001","100.537","0.001","1176.65","0.05","169.99","0.11","169.99","0.11","","","","","","","","6","P -1","-P 1","2","","","","- C23 H20 F6 N2 O3 Se -","- C23 H20 F6 N2 O3 Se -","- C46 H40 F12 N4 O6 Se2 -","2","1","","Gao, Yu-Ting; Liu, Shao-Dong; Cheng, Liang; Liu, Li","A fast and direct iodide-catalyzed oxidative 2-selenylation of tryptophan.","Chemical communications (Cambridge, England)","2021","57","28","3504","3507","10.1039/d1cc00700a","","x-ray","1.54178","CuKα","","0.0648","0.0642","","","0.1983","0.1986","","","","","","1.109","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7127998","6.5013","0.0008","14.177","0.0015","3.671","0.0004","90","","90","","90","","338.35","0.07","298","2","298.15","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Hf2 O4 S3 Y2 -","- Hf2 O4 S3 Y2 -","- Hf4 O8 S6 Y4 -","2","0.25","","Lu, Zhen-Tao; Yang, Si-Han; Liu, Wenlong; Guo, Sheng-Ping","A series of oxysulfides RE<sub>2</sub>M<sub>2</sub>S<sub>3</sub>O<sub>4</sub> (RE = Y, Tm; M = Zr, Hf) featuring a unique MS<sub>3</sub>O<sub>4</sub> motif and {[M<sub>2</sub>S<sub>3</sub>O<sub>4</sub>]<sup>8-</sup>}<sub>\ιnfty </sub> wrinkle layer.","Chemical communications (Cambridge, England)","2021","57","28","3500","3503","10.1039/d1cc00351h","","","0.71073","MoKα","","0.0281","0.0276","","","0.0737","0.0743","","","","","","1.046","","","","has coordinates","264861","2021-05-05","08:01:46",""
"7127999","6.4784","0.0007","14.1361","0.0016","3.6618","0.0005","90","","90","","90","","335.35","0.07","298","2","298.15","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- O4 S3 Tm2 Zr2 -","- O4 S3 Tm2 Zr2 -","- O8 S6 Tm4 Zr4 -","2","0.25","","Lu, Zhen-Tao; Yang, Si-Han; Liu, Wenlong; Guo, Sheng-Ping","A series of oxysulfides RE<sub>2</sub>M<sub>2</sub>S<sub>3</sub>O<sub>4</sub> (RE = Y, Tm; M = Zr, Hf) featuring a unique MS<sub>3</sub>O<sub>4</sub> motif and {[M<sub>2</sub>S<sub>3</sub>O<sub>4</sub>]<sup>8-</sup>}<sub>\ιnfty </sub> wrinkle layer.","Chemical communications (Cambridge, England)","2021","57","28","3500","3503","10.1039/d1cc00351h","","","0.71073","MoKα","","0.0353","0.0306","","","0.0723","0.0742","","","","","","1.048","","","","has coordinates","264861","2021-05-05","08:01:46",""
"7128000","7.4051","0.00012","8.24493","0.00017","21.2074","0.0004","92.7868","0.0016","90.0429","0.0014","106.864","0.0016","1237.51","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H19 N9 O5 Pt -","- C24 H19 N9 O5 Pt -","- C48 H38 N18 O10 Pt2 -","2","1","","Lu, Zhen-Tao; Yang, Si-Han; Liu, Wenlong; Guo, Sheng-Ping","A series of oxysulfides RE<sub>2</sub>M<sub>2</sub>S<sub>3</sub>O<sub>4</sub> (RE = Y, Tm; M = Zr, Hf) featuring a unique MS<sub>3</sub>O<sub>4</sub> motif and {[M<sub>2</sub>S<sub>3</sub>O<sub>4</sub>]<sup>8-</sup>}<sub>∞ </sub> wrinkle layer.","Chemical communications (Cambridge, England)","2021","57","28","3500","3503","10.1039/d1cc00351h","","x-ray","0.71073","MoKα","","0.0265","0.0223","","","0.0424","0.0439","","","","","","1.035","","","","has coordinates,has disorder","301860","2025-08-22","09:26:58",""
"7128001","16.62251","0.00011","16.92326","0.00015","21.21101","0.00015","90","","90","","90","","5966.81","0.08","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C33 H39 O4 S Sb -","- C33 H39 O4 S Sb -","- C264 H312 O32 S8 Sb8 -","8","1","","Wenger, John S.; Johnstone, Timothy C.","Unsupported monomeric stibine oxides (R<sub>3</sub>SbO) remain undiscovered.","Chemical communications (Cambridge, England)","2021","57","28","3484","3487","10.1039/d1cc00619c","","","0.71073","MoKα","","0.0268","0.0209","","","0.0563","0.059","","","","","","1.028","","","","has coordinates","264860","2021-05-05","08:01:33",""
"7128002","10.4609","0.0002","22.0134","0.0004","12.4071","0.0002","90","","95.215","0.001","90","","2845.28","0.09","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H34 F3 O4 S Sb -","- C28 H34 F3 O4 S Sb -","- C112 H136 F12 O16 S4 Sb4 -","4","1","","Wenger, John S.; Johnstone, Timothy C.","Unsupported monomeric stibine oxides (R<sub>3</sub>SbO) remain undiscovered.","Chemical communications (Cambridge, England)","2021","57","28","3484","3487","10.1039/d1cc00619c","","","0.71073","MoKα","","0.0377","0.0291","","","0.0709","0.0734","","","","","","1.068","","","","has coordinates,has disorder","264860","2021-05-05","08:01:34",""
"7128003","12.7443","0.0004","13.0965","0.0004","20.1296","0.0007","76.697","0.003","79.142","0.003","78.266","0.003","3165.73","0.18","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H58 B F24 O Sb -","- C64 H58 B F24 O Sb -","- C128 H116 B2 F48 O2 Sb2 -","2","1","","Wenger, John S.; Johnstone, Timothy C.","Unsupported monomeric stibine oxides (R<sub>3</sub>SbO) remain undiscovered.","Chemical communications (Cambridge, England)","2021","57","28","3484","3487","10.1039/d1cc00619c","","","0.71073","MoKα","","0.06","0.0517","","","0.1342","0.1399","","","","","","1.022","","","","has coordinates,has disorder","264860","2021-05-05","08:01:34",""
"7128004","9.9072","0.0006","8.9556","0.0005","15.9942","0.0011","90","","90","","90","","1419.08","0.15","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H20 N2 Na2 O10 -","- C10 H20 N2 Na2 O10 -","- C40 H80 N8 Na8 O40 -","4","0.5","","Zheng, Haoyue; Wang, Yanying; Cao, Peisheng; Wu, Peng","Color-tunable ultralong room temperature phosphorescence from EDTA.","Chemical communications (Cambridge, England)","2021","57","29","3575","3578","10.1039/d1cc00207d","","x-ray","0.71073","MoKα","","0.071","0.042","","","0.0925","0.1036","","","","","","1.032","","","","has coordinates","264858","2021-05-05","08:01:05",""
"7128005","31.0956","0.0013","15.1623","0.0006","33.462","0.0014","90","","97.441","0.001","90","","15643.8","1.1","150","","150","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C150.23 H126.23 Au9 Cl8.76 Ga3 P8 -","- C150.229 H126.229 Au9 Cl8.7542 Ga3 P8 -","- C600.916 H504.916 Au36 Cl35.0168 Ga12 P32 -","4","0.5","","Fetzer, Florian; Schrenk, Claudio; Pollard, Nia; Adeagbo, Adebola; Clayborne, Andre Z.; Schnepf, Andreas","A new reductant in gold cluster chemistry gives a superatomic gold gallium cluster.","Chemical communications (Cambridge, England)","2021","57","29","3551","3554","10.1039/d0cc07006h","","x-ray","0.71073","MoKα","","0.0672","0.0451","","","0.1009","0.1149","","","","","","1.092","","","","has coordinates,has disorder","264857","2021-05-05","08:00:56",""
"7128006","9.9663","0.0003","26.937","0.0009","30.2924","0.0009","90","","90","","90","","8132.4","0.4","293","","293","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","Ho(tppo)2(H2O)5Cl3 H2O","","- C24 H60 Cl3 Ho N6 O8 P2 -","- C24 H60 Cl3 Ho N6 O8 P2 -","- C192 H480 Cl24 Ho8 N48 O64 P16 -","8","1","","Jia, Kexin; Meng, Xixi; Wang, Mengmeng; Gou, Xiaoshuang; Wang, Yu-Xia; Xu, Na; Shi, Wei; Cheng, Peng","Enhancing the energy barrier and hysteresis temperature in two benchtop-stable Ho(iii) single-ion magnets.","Chemical communications (Cambridge, England)","2021","57","29","3607","3610","10.1039/d1cc00582k","","x-ray","0.71073","MoKα","","0.0833","0.0546","","","0.1327","0.1461","","","","","","1.038","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128007","10.0871","0.0003","26.8701","0.0008","30.9089","0.0008","90","","90","","90","","8377.6","0.4","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C24 H60 Br3 Ho N6 O8 P2 -","- C24 H60 Br3 Ho N6 O8 P2 -","- C192 H480 Br24 Ho8 N48 O64 P16 -","8","1","","Jia, Kexin; Meng, Xixi; Wang, Mengmeng; Gou, Xiaoshuang; Wang, Yu-Xia; Xu, Na; Shi, Wei; Cheng, Peng","Enhancing the energy barrier and hysteresis temperature in two benchtop-stable Ho(iii) single-ion magnets.","Chemical communications (Cambridge, England)","2021","57","29","3607","3610","10.1039/d1cc00582k","","","0.71073","MoKα","","0.0822","0.0416","","","0.0816","0.0929","","","","","","1.017","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128008","15.0576","0.0002","16.1907","0.0003","30.129","0.0003","76.0792","0.0011","77.6588","0.001","62.9932","0.0015","6305.52","0.18","100","0.1","100","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C81 H144.01 Bi6 K4 Mo3 N8 O33 -","- C80 H140.506 Bi6 K4 Mo3 N8 O32 -","- C160 H281.012 Bi12 K8 Mo6 N16 O64 -","2","1","","Qiao, Lei; Chen, Dandan; Zhu, Jun; Muñoz-Castro, Alvaro; Sun, Zhong-Ming","[Bi<sub>6</sub>Mo<sub>3</sub>(CO)<sub>9</sub>]<sup>4-</sup>: a multiple local σ-aromatic cluster containing a distorted Bi<sub>6</sub> triangular prism.","Chemical communications (Cambridge, England)","2021","57","30","3656","3659","10.1039/d1cc00734c","","x-ray","1.54184","CuKα","","0.0996","0.0927","","","0.2488","0.2556","","","","","","1.027","","","","has coordinates,has disorder","264871","2021-05-05","08:04:54",""
"7128009","20.4639","0.0001","14.4411","0.0001","27.5222","0.0002","90","","105.184","0.001","90","","7849.45","0.1","100","0.1","100","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C60 H108 Bi3 K3 Mo2 N6 O24 -","- C60 H108 Bi3 K3 Mo2 N6 O24 -","- C240 H432 Bi12 K12 Mo8 N24 O96 -","4","1","","Qiao, Lei; Chen, Dandan; Zhu, Jun; Muñoz-Castro, Alvaro; Sun, Zhong-Ming","[Bi<sub>6</sub>Mo<sub>3</sub>(CO)<sub>9</sub>]<sup>4-</sup>: a multiple local σ-aromatic cluster containing a distorted Bi<sub>6</sub> triangular prism.","Chemical communications (Cambridge, England)","2021","57","30","3656","3659","10.1039/d1cc00734c","","x-ray","1.54184","CuKα","","0.0363","0.0321","","","0.0838","0.086","","","","","","1.056","","","","has coordinates","298703","2025-04-03","05:34:20",""
"7128010","10.5667","0.0004","10.7003","0.0005","13.9406","0.0006","69.301","0.001","88.131","0.001","67.251","0.001","1349.84","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H27 N O3 S -","- C34 H27 N O3 S -","- C68 H54 N2 O6 S2 -","2","1","","Zhang, Yanshun; Wei, Yin; Shi, Min","A silver-catalyzed domino inverse electron-demand oxo-Diels-Alder reaction of 3-cyclopropylideneprop-2-en-1-ones with 2,3-dioxopyrrolidines via cyclobutane-fused furan.","Chemical communications (Cambridge, England)","2021","57","29","3599","3602","10.1039/d1cc00707f","","","0.71073","MoKα","","0.0818","0.0657","","","0.1745","0.1919","","","","","","1.024","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128011","12.128","0.0002","12.406","0.0003","13.9115","0.0003","67.688","0.002","84.053","0.002","77.848","0.002","1892.37","0.08","93","","93","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H28 N8 O2 S6 -","- C40 H28 N8 O2 S6 -","- C80 H56 N16 O4 S12 -","2","1","","Kim, Chungryeol; Lee, Dongwhan","Conducting polymers as anion-responsive chemical fuses.","Chemical communications (Cambridge, England)","2021","57","31","3773","3776","10.1039/d1cc00416f","","x-ray","1.54184","CuKα","","0.0905","0.0849","","","0.2359","0.2444","","","","","","1.059","","","","has coordinates,has disorder","301860","2025-08-22","09:26:58",""
"7128012","9.7352","0.0003","19.2736","0.0006","16.4544","0.0004","90","","94.395","0.001","90","","3078.3","0.15","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H36 F3 N5 Ni O3 S -","- C29 H36 F3 N5 Ni O3 S -","- C116 H144 F12 N20 Ni4 O12 S4 -","4","1","","McNeece, Andrew J.; Jesse, Kate A.; Filatov, Alexander S.; Schneider, Joseph E.; Anderson, John S.","Catalytic hydrogenation enabled by ligand-based storage of hydrogen.","Chemical communications (Cambridge, England)","2021","57","32","3869","3872","10.1039/d0cc08236h","","x-ray","0.41328","synchrotron","","0.0322","0.029","","","0.0832","0.0852","","","","","","1.061","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128013","10.3991","0.0005","11.3467","0.0005","15.9639","0.0008","90.377","0.002","106.279","0.002","115.57","0.001","1613.26","0.14","100","","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H48 Cl N5 Ni -","- C33 H48 Cl N5 Ni -","- C66 H96 Cl2 N10 Ni2 -","2","1","","McNeece, Andrew J.; Jesse, Kate A.; Filatov, Alexander S.; Schneider, Joseph E.; Anderson, John S.","Catalytic hydrogenation enabled by ligand-based storage of hydrogen.","Chemical communications (Cambridge, England)","2021","57","32","3869","3872","10.1039/d0cc08236h","","","0.71073","MoKα","","0.0555","0.0445","","","0.1135","0.1197","","","","","","1.049","","","","has coordinates","264864","2021-05-05","08:02:31",""
"7128014","20.8883","0.0009","22.4103","0.0009","35.1853","0.0013","90","","90","","90","","16470.7","1.1","173","2","173","2","","","","","","","","8","I m m m","-I 2 2","71","","","","- C36 H282 Cl2 Co12 Eu36 N22 Na6 O264 -","- C36 H108 Cl2 Co12 Eu36 N15 O220 -","- C72 H216 Cl4 Co24 Eu72 N30 O440 -","2","0.125","","Chen, Rong; Chen, Chao-Long; Du, Ming-Hao; Wang, Xing; Wang, Cheng; Long, La-Sheng; Kong, Xiang-Jian; Zheng, Lan-Sun","Soluble lanthanide-transition-metal clusters Ln<sub>36</sub>Co<sub>12</sub> as effective molecular electrocatalysts for water oxidation.","Chemical communications (Cambridge, England)","2021","57","29","3611","3614","10.1039/d0cc08132a","","","1.54178","CuKα","","0.0877","0.0743","","","0.2025","0.214","","","","","","1.008","","","","has coordinates,has disorder","264855","2021-05-05","08:00:11",""
"7128015","20.6147","0.0005","28.8773","0.0009","22.9058","0.001","90","","96.475","0.003","90","","13548.8","0.8","173","2","173","2","","","","","","","","8","I 1 2/m 1","-I 2y","12","","","","- C36 H286 Cl4 Co12 Gd36 N20 Na6 O260 -","- C36 H132 Cl6 Co12 Gd36 N O183 -","- C72 H264 Cl12 Co24 Gd72 N2 O366 -","2","0.25","","Chen, Rong; Chen, Chao-Long; Du, Ming-Hao; Wang, Xing; Wang, Cheng; Long, La-Sheng; Kong, Xiang-Jian; Zheng, Lan-Sun","Soluble lanthanide-transition-metal clusters Ln<sub>36</sub>Co<sub>12</sub> as effective molecular electrocatalysts for water oxidation.","Chemical communications (Cambridge, England)","2021","57","29","3611","3614","10.1039/d0cc08132a","","","1.54184","CuKα","","0.1246","0.1067","","","0.298","0.3092","","","","","","1.084","","","","has coordinates","264855","2021-05-05","08:00:22",""
"7128016","20.8551","0.0003","22.5329","0.0004","35.0623","0.0005","90","","90","","90","","16476.7","0.4","173","2","173","2","","","","","","","","7","I m m m","-I 2 2","71","","","","- C36 H306 Cl11 Eu36 N7 Ni12 O231 -","- C36 H108 Cl5 Eu36 N7 Ni12 O201 -","- C72 H216 Cl10 Eu72 N14 Ni24 O402 -","2","0.125","","Chen, Rong; Chen, Chao-Long; Du, Ming-Hao; Wang, Xing; Wang, Cheng; Long, La-Sheng; Kong, Xiang-Jian; Zheng, Lan-Sun","Soluble lanthanide-transition-metal clusters Ln<sub>36</sub>Co<sub>12</sub> as effective molecular electrocatalysts for water oxidation.","Chemical communications (Cambridge, England)","2021","57","29","3611","3614","10.1039/d0cc08132a","","","1.54184","CuKα","","0.1017","0.0939","","","0.2422","0.2491","","","","","","1.053","","","","has coordinates,has disorder","264855","2021-05-05","08:00:27",""
"7128017","28.9037","0.0005","28.6333","0.0004","20.55","0.0003","90","","128.598","0.002","90","","13292","0.5","123","2","123","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C36 H306 Cl11 Dy36 N7 Ni12 O231 -","- C36 H132 Cl6 Dy36 N9 Ni12 O234 -","- C72 H264 Cl12 Dy72 N18 Ni24 O468 -","2","0.25","","Chen, Rong; Chen, Chao-Long; Du, Ming-Hao; Wang, Xing; Wang, Cheng; Long, La-Sheng; Kong, Xiang-Jian; Zheng, Lan-Sun","Soluble lanthanide-transition-metal clusters Ln<sub>36</sub>Co<sub>12</sub> as effective molecular electrocatalysts for water oxidation.","Chemical communications (Cambridge, England)","2021","57","29","3611","3614","10.1039/d0cc08132a","","","1.54178","CuKα","","0.0921","0.0842","","","0.235","0.2441","","","","","","1.039","","","","has coordinates","264855","2021-05-05","08:00:32",""
"7128018","20.7166","0.0004","28.7371","0.0006","22.7267","0.0005","90","","97.129","0.002","90","","13425.4","0.5","173","2","173","2","","","","","","","","8","I 1 2/m 1","-I 2y","12","","","","- C36 H286 Cl4 Co12 Dy36 N20 Na6 O260 -","- C38 H108 Cl2 Co12 Dy36 N13 O224 -","- C76 H216 Cl4 Co24 Dy72 N26 O448 -","2","0.25","","Chen, Rong; Chen, Chao-Long; Du, Ming-Hao; Wang, Xing; Wang, Cheng; Long, La-Sheng; Kong, Xiang-Jian; Zheng, Lan-Sun","Soluble lanthanide-transition-metal clusters Ln<sub>36</sub>Co<sub>12</sub> as effective molecular electrocatalysts for water oxidation.","Chemical communications (Cambridge, England)","2021","57","29","3611","3614","10.1039/d0cc08132a","","","1.54184","CuKα","","0.0784","0.0647","","","0.1831","0.191","","","","","","1.109","","","","has coordinates,has disorder","264855","2021-05-05","08:00:32",""
"7128019","5.5189","0.0004","6.9129","0.0004","11.8527","0.0008","90.598","0.001","92.151","0.001","109.895","0.001","424.78","0.05","296","2","296","2","","","","","","","","5","P 1","P 1","1","","","","- Ag2 Bi2 I4 O20 S2 -","- Ag2 Bi2 I4 O20 S2 -","- Ag2 Bi2 I4 O20 S2 -","1","1","","Liu, Hongming; Wu, Qingchen; Liu, Lili; Lin, Zheshuai; Halasyamani, P. Shiv; Chen, Xingguo; Qin, Jingui","AgBi(SO<sub>4</sub>)(IO<sub>3</sub>)<sub>2</sub>: aliovalent substitution induces structure dimensional upgrade and second harmonic generation enhancement.","Chemical communications (Cambridge, England)","2021","57","30","3712","3715","10.1039/d0cc07862j","","","0.71073","MoKα","","0.0368","0.0368","","","0.0905","0.0905","","","","","","1.065","","","","has coordinates","264874","2021-05-05","08:06:36",""
"7128020","14.4966","0.0016","10.4123","0.0011","11.2334","0.001","90","","111.258","0.005","90","","1580.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 Br N O -","- C18 H16 Br N O -","- C72 H64 Br4 N4 O4 -","4","1","","Ramesh, Balu; Jeganmohan, Masilamani","Cobalt(iii)-catalyzed redox-neutral [4+2]-annulation of N-chlorobenzamides/acrylamides with alkylidenecyclopropanes at room temperature.","Chemical communications (Cambridge, England)","2021","57","30","3692","3695","10.1039/d1cc00654a","","","0.71073","MoKα","","0.1245","0.0576","","","0.0885","0.0947","","","","","","1.674","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128021","17.1395","0.0009","10.0131","0.0005","18.1242","0.0009","90","","105.326","0.002","90","","2999.9","0.3","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H44 Ga N2 Sb -","- C29 H44 Ga N2 Sb -","- C116 H176 Ga4 N8 Sb4 -","4","1","","Schneider, Selina; Ivlev, Sergei; von Hänisch, Carsten","Stibine as a reagent in molecular chemistry - targeted synthesis of primary and secondary stibanyl-gallanes and their lighter homologues.","Chemical communications (Cambridge, England)","2021","57","31","3781","3784","10.1039/d0cc08419k","","x-ray","0.71073","MoKα","","0.03","0.0229","","","0.0516","0.054","","","","","","1.034","","","","has coordinates,has disorder","264878","2021-05-05","08:07:36",""
"7128022","14.399","0.0007","14.4137","0.0007","14.9394","0.0007","85.495","0.002","85.477","0.002","64.209","0.002","2779.6","0.2","100","","100","","","","","","","","","5","P 1","P 1","1","","","","- C58 H85 Ga2 N4 Sb -","- C58 H85 Ga2 N4 Sb -","- C116 H170 Ga4 N8 Sb2 -","2","2","","Schneider, Selina; Ivlev, Sergei; von Hänisch, Carsten","Stibine as a reagent in molecular chemistry - targeted synthesis of primary and secondary stibanyl-gallanes and their lighter homologues.","Chemical communications (Cambridge, England)","2021","57","31","3781","3784","10.1039/d0cc08419k","","","0.71073","MoKα","","0.04","0.0316","","","0.0562","0.0588","","","","","","0.998","","","","has coordinates,has disorder","264878","2021-05-05","08:07:36",""
"7128023","14.2902","0.0012","14.298","0.0012","14.8863","0.0012","85.241","0.002","85.225","0.002","64.92","0.002","2741.4","0.4","100","","100","","","","","","","","","5","P 1","P 1","1","","","","- C58 H85 As Ga2 N4 -","- C58 H85 As Ga2 N4 -","- C116 H170 As2 Ga4 N8 -","2","2","","Schneider, Selina; Ivlev, Sergei; von Hänisch, Carsten","Stibine as a reagent in molecular chemistry - targeted synthesis of primary and secondary stibanyl-gallanes and their lighter homologues.","Chemical communications (Cambridge, England)","2021","57","31","3781","3784","10.1039/d0cc08419k","","","0.71073","MoKα","","0.0276","0.0247","","","0.0591","0.0606","","","","","","1.019","","","","has coordinates,has disorder","264878","2021-05-05","08:07:36",""
"7128024","18.1045","0.0011","9.6018","0.0006","33.3947","0.0019","90","","90.888","0.001","90","","5804.5","0.6","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H44 Ga N2 P -","- C29 H44 Ga N2 P -","- C232 H352 Ga8 N16 P8 -","8","2","","Schneider, Selina; Ivlev, Sergei; von Hänisch, Carsten","Stibine as a reagent in molecular chemistry - targeted synthesis of primary and secondary stibanyl-gallanes and their lighter homologues.","Chemical communications (Cambridge, England)","2021","57","31","3781","3784","10.1039/d0cc08419k","","","0.71073","MoKα","","0.0526","0.0389","","","0.0945","0.1008","","","","","","1.049","","","","has coordinates,has disorder","264878","2021-05-05","08:07:36",""
"7128025","18.1546","0.001","9.6556","0.0005","33.4172","0.0019","90","","91.133","0.002","90","","5856.7","0.6","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H44 As Ga N2 -","- C29 H43.788 As Ga N2 -","- C232 H350.304 As8 Ga8 N16 -","8","2","","Schneider, Selina; Ivlev, Sergei; von Hänisch, Carsten","Stibine as a reagent in molecular chemistry - targeted synthesis of primary and secondary stibanyl-gallanes and their lighter homologues.","Chemical communications (Cambridge, England)","2021","57","31","3781","3784","10.1039/d0cc08419k","","","0.71073","MoKα","","0.042","0.03","","","0.0617","0.0653","","","","","","1.043","","","","has coordinates,has disorder","264878","2021-05-05","08:07:36",""
"7128026","16.2332","0.0001","14.5933","0.0001","31.828","0.0003","90","","93.53","0.001","90","","7525.62","0.1","173.15","","173.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H20 Co2 N6 O8 -","- C28 H20 Co2 N6 O8 -","- C224 H160 Co16 N48 O64 -","8","1","","Ji, Zhenyu; Fan, Yerong; Wu, Mingyan; Hong, Maochun","A flexible microporous framework with temperature-dependent gate-opening behaviours for C2 gases.","Chemical communications (Cambridge, England)","2021","57","31","3785","3788","10.1039/d1cc00014d","","","1.3405","GaKα","","0.036","0.0294","","","0.0706","0.0734","","","","","","1.041","","","","has coordinates","264879","2021-05-05","08:07:49",""
"7128027","10.01","0.0004","18.7883","0.0005","16.0273","0.0005","90","","95.972","0.003","90","","2997.91","0.17","293","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 Co2 N6 O8 -","- C28 H22 Co2 N6 O8 -","- C112 H88 Co8 N24 O32 -","4","1","","Ji, Zhenyu; Fan, Yerong; Wu, Mingyan; Hong, Maochun","A flexible microporous framework with temperature-dependent gate-opening behaviours for C2 gases.","Chemical communications (Cambridge, England)","2021","57","31","3785","3788","10.1039/d1cc00014d","","","1.3405","GaKα","","0.0673","0.0394","","","0.1031","0.1143","","","","","","1.031","","","","has coordinates","264879","2021-05-05","08:07:49",""
"7128028","14.9017","0.0002","5.4745","0.0001","16.0571","0.0002","90","","98.873","0.001","90","","1294.25","0.03","120","0.1","120","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- La2.31 N10.31 O1.69 Si5 Sr3.69 -","- La2.31 N10.31 O1.69 Si5 Sr3.69 -","- La9.24 N41.24 O6.76 Si20 Sr14.76 -","4","1","","Zheng, Hong-Wei; Wang, Xiao-Ming; Wei, Heng-Wei; Zheng, Yu; Yin, Cong-Ling; Yang, Zu-Pei; Jiao, Huan","Narrow-band red emitting oxonitridosilicate phosphor La<sub>4-x</sub>Sr<sub>2+x</sub>Si<sub>5</sub>N<sub>12-x</sub>O<sub>x</sub>:Pr<sup>3+</sup> (x≈ 1.69).","Chemical communications (Cambridge, England)","2021","57","31","3761","3764","10.1039/d1cc00893e","","x-ray","1.54184","CuKα","","0.044","0.0354","","","0.0913","0.0956","","","","","","1.072","","","","has coordinates,has disorder","264880","2021-05-05","08:07:58",""
"7128029","14.90289","0.00012","5.46328","0.00005","16.00855","0.00013","90","","98.9959","0.0005","90","","1287.36","0.019","297","","297","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- Ce2.44 N10.44 O1.56 Si5 Sr3.56 -","- Ce2.44 N10.44 O1.56 Si5 Sr3.56 -","- Ce9.76 N41.76 O6.24 Si20 Sr14.24 -","4","1","","Zheng, Hong-Wei; Wang, Xiao-Ming; Wei, Heng-Wei; Zheng, Yu; Yin, Cong-Ling; Yang, Zu-Pei; Jiao, Huan","Narrow-band red emitting oxonitridosilicate phosphor La<sub>4-x</sub>Sr<sub>2+x</sub>Si<sub>5</sub>N<sub>12-x</sub>O<sub>x</sub>:Pr<sup>3+</sup> (x≈ 1.69).","Chemical communications (Cambridge, England)","2021","57","31","3761","3764","10.1039/d1cc00893e","powder diffraction","","1.5418","CuKα","","0.0395","","","","","","","","2","","","","","","","has coordinates","264880","2021-05-05","08:07:58",""
"7128030","9.1087","0.0009","10.9966","0.0011","14.9346","0.0015","90","","93.732","0.005","90","","1492.7","0.3","298.15","","298.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","4(5-fu).(bpe)","5-fluoro-1H,3H-pyrimidine-2,4-dione, 1,2-bis(4-pyridyl)ethylene","","- C28 H22 F4 N10 O8 -","- C28 H22 F4 N10 O8 -","- C56 H44 F8 N20 O16 -","2","0.5","","Ortiz-de León, Celymar; MacGillivray, Leonard R.","Clues from cocrystals: a ternary solid, polymorphism, and rare supramolecular isomerism involving resveratrol and 5-fluorouracil.","Chemical communications (Cambridge, England)","2021","57","31","3809","3811","10.1039/d0cc08388g","","","0.71073","MoKα","","0.0564","0.0388","","","0.1032","0.1128","","","","","","1.05","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128031","9.4819","0.0009","10.6517","0.0011","13.506","0.0014","76.407","0.005","85.696","0.005","88.382","0.005","1322.1","0.2","298","2","298.15","","","","","","","","","5","P -1","-P 1","2","(resv).(bpe).(5-fu)","3,5,4'-trihydroxy-trans-stilbene, 1,2-bis(4-pyridyl)ethylene, 5-fluoro-1H,3H-pyrimidine-2,4-dione","","- C30 H25 F N4 O5 -","- C30 H25 F N4 O5 -","- C60 H50 F2 N8 O10 -","2","1","","Ortiz-de León, Celymar; MacGillivray, Leonard R.","Clues from cocrystals: a ternary solid, polymorphism, and rare supramolecular isomerism involving resveratrol and 5-fluorouracil.","Chemical communications (Cambridge, England)","2021","57","31","3809","3811","10.1039/d0cc08388g","","","0.71073","MoKα","","0.1605","0.0584","","","0.126","0.1677","","","","","","0.969","","","","has coordinates,has disorder","301860","2025-08-22","09:26:58",""
"7128032","8.1814","0.0003","11.4924","0.0004","21.1523","0.0008","90","","90","","90","","1988.82","0.13","100.01","0.1","100.01","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H19 I O2 S2 -","- C21 H19 I O2 S2 -","- C84 H76 I4 O8 S8 -","4","1","","Duan, Longhui; Wang, Zhonggui; Zhao, Kun; Gu, Zhenhua","Enantioselective preparation of atropisomeric biaryl trifluoromethylsulfanes via ring-opening of cyclic diaryliodoniums.","Chemical communications (Cambridge, England)","2021","57","32","3881","3884","10.1039/d1cc00171j","","x-ray","0.71073","MoKα","","0.0333","0.0288","","","0.0539","0.0562","","","","","","1.049","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128033","9.1979","0.0002","13.5767","0.0002","24.3814","0.0004","90","","90","","90","","3044.68","0.09","149.99","0.1","149.99","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C33 H26 F3 O4 P S2 -","- C33 H26 F3 O4 P S2 -","- C132 H104 F12 O16 P4 S8 -","4","1","","Duan, Longhui; Wang, Zhonggui; Zhao, Kun; Gu, Zhenhua","Enantioselective preparation of atropisomeric biaryl trifluoromethylsulfanes via ring-opening of cyclic diaryliodoniums.","Chemical communications (Cambridge, England)","2021","57","32","3881","3884","10.1039/d1cc00171j","","x-ray","1.54184","CuKα","","0.0451","0.0427","","","0.1085","0.1112","","","","","","1.024","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128034","8.3423","0.0008","9.5634","0.0007","15.2295","0.0015","89.937","0.007","79.651","0.008","77.95","0.007","1168.08","0.19","100.01","0.1","100.01","0.1","","","","","","","","6","P 1","P 1","1","","","","- C27 H22 F3 O P S -","- C27 H22 F3 O P S -","- C54 H44 F6 O2 P2 S2 -","2","2","","Duan, Longhui; Wang, Zhonggui; Zhao, Kun; Gu, Zhenhua","Enantioselective preparation of atropisomeric biaryl trifluoromethylsulfanes via ring-opening of cyclic diaryliodoniums.","Chemical communications (Cambridge, England)","2021","57","32","3881","3884","10.1039/d1cc00171j","","x-ray","0.71073","MoKα","","0.0791","0.0659","","","0.1539","0.1677","","","","","","1.042","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128035","9.8537","0.0011","22.588","0.003","22.749","0.003","90","","97.22","0.004","90","","5023.2","1.1","150","2","150","2","","","","","","","synthesis as described","8","P 1 21/n 1","-P 2yn","14","","","","- C51 H67 Cl3 F6 N4 O2 P Rh -","- C51 H67 Cl3 F6 N4 O2 P Rh -","- C204 H268 Cl12 F24 N16 O8 P4 Rh4 -","4","1","","Tarrieu, Robert; Delgado, Irene Hernandez; Zinna, Francesco; Dorcet, Vincent; Colombel-Rouen, Sophie; Crévisy, Christophe; Baslé, Olivier; Bosson, Johann; Lacour, Jérôme","Hybrids of cationic [4]helicene and N-heterocyclic carbene as ligands for complexes exhibiting (chir)optical properties in the far red spectral window.","Chemical communications (Cambridge, England)","2021","57","31","3793","3796","10.1039/d1cc00898f","","x-ray","0.71073","MoKα","","0.1861","0.1633","","","0.3558","0.3665","","","","","","1.293","","","","has coordinates,has disorder","264875","2021-05-05","08:06:49",""
"7128036","9.8906","0.0006","12.5154","0.0009","19.2461","0.0013","88.465","0.002","86.617","0.002","87.886","0.002","2375.9","0.3","150","2","150","2","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C44 H57 Cl4 F6 N4 O2 P Se -","- C44 H57 Cl4 F6 N4 O2 P Se -","- C88 H114 Cl8 F12 N8 O4 P2 Se2 -","2","1","","Tarrieu, Robert; Delgado, Irene Hernandez; Zinna, Francesco; Dorcet, Vincent; Colombel-Rouen, Sophie; Crévisy, Christophe; Baslé, Olivier; Bosson, Johann; Lacour, Jérôme","Hybrids of cationic [4]helicene and N-heterocyclic carbene as ligands for complexes exhibiting (chir)optical properties in the far red spectral window.","Chemical communications (Cambridge, England)","2021","57","31","3793","3796","10.1039/d1cc00898f","","x-ray","0.71073","MoKα","","0.091","0.052","","","0.1292","0.1493","","","","","","1.005","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128037","18.4663","0.0005","7.888","0.0002","10.6546","0.0003","90","","93.091","0.001","90","","1549.71","0.07","210","2","210","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H22 N2 O4 -","- C15 H22 N2 O4 -","- C60 H88 N8 O16 -","4","1","","Liu, Huijing; Zhang, Sisi; Ding, Liping; Fang, Yu","Dual-state efficient chromophore with pH-responsive and solvatofluorochromic properties based on an asymmetric single benzene framework.","Chemical communications (Cambridge, England)","2021","57","33","4011","4014","10.1039/d1cc00718a","","","1.34139","GaKα","","0.0399","0.0356","","","0.1032","0.108","","","","","","0.908","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128038","7.7989","0.0001","15.9461","0.0002","30.2933","0.0003","90","","90","","90","","3767.34","0.08","100","0.1","100","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-1-(2-(9,10-dihydrophenanthren-9-yl)ethylidene)-2-(2,4-dinitrophenyl)hydrazine","","- C22 H18 N4 O4 -","- C22 H18 N4 O4 -","- C176 H144 N32 O32 -","8","2","","Willems, Suzanne; Toupalas, Georgios; Reisenbauer, Julia C.; Morandi, Bill","A site-selective and stereospecific cascade Suzuki-Miyaura annulation of alkyl 1,2-bisboronic esters and 2,2'-dihalo 1,1'-biaryls.","Chemical communications (Cambridge, England)","2021","57","32","3909","3912","10.1039/d1cc00648g","","x-ray","1.54184","CuKα","","0.0352","0.0341","","","0.0834","0.0844","","","","","","1.039","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128039","4.835","0.0002","18.9867","0.0006","8.4861","0.0003","90","","122.835","0.002","90","","654.57","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- B4 Ba F4 O5 -","- B4 Ba F4 O5 -","- B16 Ba4 F16 O20 -","4","1","","Zhang, Wenbin; Guo, Siru; Han, Shujuan; Wang, Liying; Zhou, Xin; Yang, Zhihua; Pan, Shilie","BaB<sub>4</sub>O<sub>5</sub>F<sub>4</sub> with reversible phase transition featuring unprecedented fundamental building blocks of [B<sub>16</sub>O<sub>21</sub>F<sub>16</sub>] in the <i>α</i>-phase and [B<sub>4</sub>O<sub>6</sub>F<sub>4</sub>] in the <i>β</i>-phase.","Chemical communications (Cambridge, England)","2021","57","34","4182","4185","10.1039/d1cc00701g","","","0.71073","MoKα","","0.0185","0.0169","","","0.0394","0.0399","","","","","","1.079","","","","has coordinates","264891","2021-05-05","08:11:32",""
"7128040","4.8464","0.0002","18.6556","0.0006","14.1231","0.0005","90","","91.934","0.0012","90","","1276.18","0.08","153","","153","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- B4 Ba F4 O5 -","- B4 Ba F4 O5 -","- B32 Ba8 F32 O40 -","8","4","","Zhang, Wenbin; Guo, Siru; Han, Shujuan; Wang, Liying; Zhou, Xin; Yang, Zhihua; Pan, Shilie","BaB<sub>4</sub>O<sub>5</sub>F<sub>4</sub> with reversible phase transition featuring unprecedented fundamental building blocks of [B<sub>16</sub>O<sub>21</sub>F<sub>16</sub>] in the <i>α</i>-phase and [B<sub>4</sub>O<sub>6</sub>F<sub>4</sub>] in the <i>β</i>-phase.","Chemical communications (Cambridge, England)","2021","57","34","4182","4185","10.1039/d1cc00701g","","","0.71073","MoKα","","0.0234","0.0207","","","0.0495","0.0503","","","","","","1.019","","","","has coordinates","264891","2021-05-05","08:11:33",""
"7128041","9.212","0.0015","16.537","0.002","13.109","0.003","90","","106.649","0.018","90","","1913.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H48 N2 Ni O10 -","- C42 H48 N2 Ni O10 -","- C84 H96 N4 Ni2 O20 -","2","0.5","","Li, Qi; Zhang, Qian; Wei, Wu-Ji; Wang, A-Ni; Hu, Ji-Xiang; Wang, Guo-Ming","Light actuated stable radicals of the 9-anthracene carboxylic acid for designing new photochromic complexes.","Chemical communications (Cambridge, England)","2021","57","35","4295","4298","10.1039/d1cc00920f","","","0.71073","MoKα","","0.0613","0.0455","","","0.1237","0.1351","","","","","","1.049","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128042","39.8703","0.0002","28.1508","0.0001","63.1542","0.0003","90","","92.711","0.001","90","","70803.7","0.6","200","0.1","200.15","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C16 H64 Cu8 K20 N16 Na19 Nb144 O478 -","- C16 H64 Cu8 K20 N16 Na19 Nb144 O478 -","- C64 H256 Cu32 K80 N64 Na76 Nb576 O1912 -","4","1","","Liang, Zhijie; Qiao, Yuanyuan; Li, Xue; Ma, Pengtao; Niu, Jingyang; Wang, Jingping","A large copper-niobate cluster with the pagoda-shaped subunit {Nb<sub>20</sub>O<sub>59</sub>}.","Chemical communications (Cambridge, England)","2021","57","33","3999","4002","10.1039/d1cc00758k","","","1.54178","CuKα","","0.0958","0.0769","","","0.1942","0.2077","","","","","","1.023","","","","has coordinates,has disorder","264868","2021-05-05","08:03:45",""
"7128043","12.9917","0.0004","21.9009","0.0005","22.5682","0.0003","95.436","0.002","95.461","0.002","92.331","0.002","6355.4","0.3","169.99","0.11","169.99","0.11","","","","","","","","4","P -1","-P 1","2","","","","- C123 H153 Cl9 O10 -","- C123 H153 Cl9 O10 -","- C246 H306 Cl18 O20 -","2","1","","Wang, Jia-Qi; Han, Ying; Chen, Chuan-Feng","3,6-Fluoren[5]arenes: synthesis, structure and complexation with fullerenes C<sub>60</sub> and C<sub>70</sub>.","Chemical communications (Cambridge, England)","2021","57","33","3987","3990","10.1039/d1cc00916h","","x-ray","1.54184","CuKα","","0.1256","0.093","","","0.2534","0.2809","","","","","","1.031","","","","has coordinates,has disorder","301860","2025-08-22","09:26:58",""
"7128044","19.83","0.005","15.111","0.003","25.233","0.008","90","","93.958","0.019","90","","7543","3","130","2","130.01","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C124 H50 N5 Ni Sc3 -","- C124 H50 N5 Ni Sc3 -","- C496 H200 N20 Ni4 Sc12 -","4","1","","Guo, Min; Li, Xiaomeng; Yao, Yang-Rong; Zhuang, Jiaxin; Meng, Qingyu; Yan, Yingjing; Liu, Xinye; Chen, Ning","A non-isolated pentagon rule C<sub>82</sub> cage stabilized by a stretched Sc<sub>3</sub>N cluster.","Chemical communications (Cambridge, England)","2021","57","34","4150","4153","10.1039/d1cc00328c","","","1.54178","CuKα","","0.0921","0.0794","","","0.221","0.2368","","","","","","1.057","","","","has coordinates,has disorder","264890","2021-05-05","08:11:23",""
"7128045","5.3937","0.0002","5.4359","0.0002","35.4175","0.0015","90","","90.977","0.003","90","","1038.28","0.07","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","2-(4-{Dodec-1-yn-1-yl}pyrazol-1-yl)-6-(pyrazol-1-yl)pyridine","","- C23 H29 N5 -","- C23 H29 N5 -","- C46 H58 N10 -","2","1","","Galadzhun, Iurii; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Howard, Mark J.; Halcrow, Malcolm A.","The flexibility of long chain substituents influences spin-crossover in isomorphous lipid bilayer crystals.","Chemical communications (Cambridge, England)","2021","57","33","4039","4042","10.1039/d1cc01073e","","","0.6889","synchrotron","","0.1019","0.0896","","","0.2298","0.2395","","","","","","1.128","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128046","5.389","0.0001","10.1738","0.0001","19.2473","0.0003","95.529","0.001","94.405","0.001","90.258","0.001","1047.18","0.03","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","2-(4-Dodecylpyrazol-1-yl)-6-(pyrazol-1-yl)pyridine","","- C23 H33 N5 -","- C23 H33 N5 -","- C46 H66 N10 -","2","1","","Galadzhun, Iurii; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Howard, Mark J.; Halcrow, Malcolm A.","The flexibility of long chain substituents influences spin-crossover in isomorphous lipid bilayer crystals.","Chemical communications (Cambridge, England)","2021","57","33","4039","4042","10.1039/d1cc01073e","","","0.6889","synchrotron","","0.0812","0.0543","","","0.1385","0.1492","","","","","","0.972","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128047","5.3976","0.0001","10.1852","0.0001","20.8348","0.0003","87.345","0.001","84.116","0.001","89.84","0.001","1138.15","0.03","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","2-(4-Tetradecylpyrazol-1-yl)-6-(pyrazol-1-yl)pyridine","","- C25 H37 N5 -","- C25 H37 N5 -","- C50 H74 N10 -","2","1","","Galadzhun, Iurii; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Howard, Mark J.; Halcrow, Malcolm A.","The flexibility of long chain substituents influences spin-crossover in isomorphous lipid bilayer crystals.","Chemical communications (Cambridge, England)","2021","57","33","4039","4042","10.1039/d1cc01073e","","","0.6889","synchrotron","","0.0777","0.0609","","","0.1666","0.1798","","","","","","1.032","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128048","10.8639","0.0002","15.2602","0.0003","30.1058","0.0006","97.198","0.002","97.749","0.002","90.119","0.002","4905.63","0.17","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis-[2-(4-dodecylpyrazol-1-yl)-6-(pyrazol-1-yl)pyridine]iron(II)ditetrafluoroborate","","- C46 H66 B2 F8 Fe N10 -","- C46 H66 B2 F8 Fe N10 -","- C184 H264 B8 F32 Fe4 N40 -","4","2","","Galadzhun, Iurii; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Howard, Mark J.; Halcrow, Malcolm A.","The flexibility of long chain substituents influences spin-crossover in isomorphous lipid bilayer crystals.","Chemical communications (Cambridge, England)","2021","57","33","4039","4042","10.1039/d1cc01073e","","","0.6889","synchrotron","","0.1937","0.0755","","","0.1659","0.2162","","","","","","0.88","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128049","17.7969","0.0002","8.4754","0.0001","19.1353","0.0001","90","","90","","90","","2886.29","0.05","169.99","0.1","169.99","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C17 H14 F3 N O -","- C17 H14 F3 N O -","- C136 H112 F24 N8 O8 -","8","1","","Ji, Wangqin; Wu, Hai-Hong; Li, Wenbo; Zhang, Junliang","Copper-catalyzed cyclization reaction: synthesis of trifluoromethylated indolinyl ketones.","Chemical communications (Cambridge, England)","2021","57","36","4448","4451","10.1039/d1cc00960e","","x-ray","1.54184","CuKα","","0.0377","0.036","","","0.0929","0.0942","","","","","","1.082","","","","has coordinates","301860","2025-08-22","09:26:58",""
"7128050","16.8549","0.0014","9.7346","0.0007","10.8047","0.0008","90","","102.873","0.008","90","","1728.2","0.2","291.9","0.16","291.9","0.16","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 B Br N O5 -","- C16 H19 B Br N O5 -","- C64 H76 B4 Br4 N4 O20 -","4","1","","Wang, Lucia; Lin, Shengjia; Zhu, Yawei; Ferrante, Daniel; Ishak, Timaf; Baba, Yuki; Sharma, Abhishek","α-Hydroxy boron-enabled regioselective access to bifunctional halo-boryl alicyclic ethers and α-halo borons.","Chemical communications (Cambridge, England)","2021","57","37","4564","4567","10.1039/d1cc00336d","","x-ray","0.71073","MoKα","","0.1355","0.0664","","","0.1263","0.1582","","","","","","1.018","","","","has coordinates","301860","2025-08-22","09:26:59",""
"7128051","11.7731","0.0008","6.9423","0.0004","40.482","0.003","90","","90","","90","","3308.7","0.4","292.11","0.19","292.11","0.19","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C15 H17 B Br N O5 -","- C15 H17 B Br N O5 -","- C120 H136 B8 Br8 N8 O40 -","8","2","","Wang, Lucia; Lin, Shengjia; Zhu, Yawei; Ferrante, Daniel; Ishak, Timaf; Baba, Yuki; Sharma, Abhishek","α-Hydroxy boron-enabled regioselective access to bifunctional halo-boryl alicyclic ethers and α-halo borons.","Chemical communications (Cambridge, England)","2021","57","37","4564","4567","10.1039/d1cc00336d","","x-ray","1.54184","CuKα","","0.0996","0.0832","","","0.2259","0.2401","","","","","","1.079","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128052","17.729","0.001","12.9542","0.0007","13.1242","0.001","90","","109.149","0.007","90","","2847.4","0.3","293.21","0.1","293.21","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H17 B Br N O5 -","- C11 H17 B Br N O5 -","- C88 H136 B8 Br8 N8 O40 -","8","1","","Wang, Lucia; Lin, Shengjia; Zhu, Yawei; Ferrante, Daniel; Ishak, Timaf; Baba, Yuki; Sharma, Abhishek","α-Hydroxy boron-enabled regioselective access to bifunctional halo-boryl alicyclic ethers and α-halo borons.","Chemical communications (Cambridge, England)","2021","57","37","4564","4567","10.1039/d1cc00336d","","x-ray","1.54184","CuKα","","0.0571","0.0477","","","0.1294","0.1377","","","","","","1.059","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128053","15.325","0.001","10.1376","0.0007","17.7593","0.0011","90","","103.791","0.003","90","","2679.5","0.3","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C34 H32 N4 -","- C34 H32 N4 -","- C136 H128 N16 -","4","1","","Kalaiselvan, Arumugan; Spergen, Aswini; Krishna, Isukapalli Sai Vamsi; Reddy, Vennapusa Sivaranjana; Gokulnath, Sabapathi","Double intramolecular hydrogen transfer assisted dual emission in a carbazole-embedded porphyrin-like macrocycle.","Chemical communications (Cambridge, England)","2021","57","36","4420","4423","10.1039/d1cc00868d","","","0.71073","MoKα","","0.105","0.0517","","","0.1252","0.1613","","","","","","1.044","","","","has coordinates,has disorder","301860","2025-08-22","09:27:02",""
"7128054","15.1534","0.0015","11.5996","0.0011","22.244","0.002","90","","99.375","0.003","90","","3857.7","0.6","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H30 F10 N4 -","- C46 H30 F10 N4 -","- C184 H120 F40 N16 -","4","1","","Kalaiselvan, Arumugan; Spergen, Aswini; Krishna, Isukapalli Sai Vamsi; Reddy, Vennapusa Sivaranjana; Gokulnath, Sabapathi","Double intramolecular hydrogen transfer assisted dual emission in a carbazole-embedded porphyrin-like macrocycle.","Chemical communications (Cambridge, England)","2021","57","36","4420","4423","10.1039/d1cc00868d","","","0.71073","MoKα","","0.1284","0.0509","","","0.1067","0.1453","","","","","","0.999","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128055","17.3497","0.0011","19.2946","0.0012","20.3454","0.0012","78.751","0.002","86.794","0.002","82.449","0.002","6618.8","0.7","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C38 H35 N5 -","- C38 H35 N5 -","- C304 H280 N40 -","8","4","","Kalaiselvan, Arumugan; Spergen, Aswini; Krishna, Isukapalli Sai Vamsi; Reddy, Vennapusa Sivaranjana; Gokulnath, Sabapathi","Double intramolecular hydrogen transfer assisted dual emission in a carbazole-embedded porphyrin-like macrocycle.","Chemical communications (Cambridge, England)","2021","57","36","4420","4423","10.1039/d1cc00868d","","","0.71073","MoKα","","0.1599","0.0632","","","0.1583","0.2169","","","","","","1.017","","","","has coordinates,has disorder","265893","2021-06-05","17:31:27",""
"7128056","13.135","0.002","10.7195","0.0017","13.166","0.002","90","","102.281","0.01","90","","1811.4","0.5","302","2","302","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-(2,6-dimethylphenyl)-2-pivalamidobenzamide","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C80 H88 N8 O8 -","4","1","","Yao, Tuanli; Wang, Bo; Ren, Beige; Qin, Xiangyang; Li, Tao","Palladium-catalyzed Ugi-type reaction of 2-iodoanilines with isocyanides and carboxylic acids affording <i>N</i>-acyl anthranilamides.","Chemical communications (Cambridge, England)","2021","57","35","4247","4250","10.1039/d1cc01226f","","","0.71073","MoKα","","0.1789","0.0621","","","0.1478","0.1964","","","","","","1.014","","","","has coordinates","264881","2021-05-05","08:08:14",""
"7128057","18.408","0.006","23.209","0.007","30.524","0.012","90","","90.126","0.005","90","","13041","8","100","","100","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C70 H170 Br12 Mn18 N18 O42 -","- C60 H130 Br12 Mn18 N18 O32 -","- C240 H520 Br48 Mn72 N72 O128 -","4","0.5","","Coletta, Marco; Tziotzi, Thomais G.; Gray, Mark; Nichol, Gary S.; Singh, Mukesh K.; Milios, Constantinos J.; Brechin, Euan K.","A [Mn<sub>18</sub>] wheel-of-wheels.","Chemical communications (Cambridge, England)","2021","57","34","4122","4125","10.1039/d1cc00185j","","x-ray","0.6889","Synchrotron","","0.146","0.1166","","","0.3142","0.3477","","","","","","1.085","","","","has coordinates","264889","2021-05-05","08:11:06",""
"7128058","13.9263","0.001","12.3383","0.0009","7.8707","0.0006","90","","97.311","0.003","90","","1341.4","0.17","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 O S2 -","- C16 H12 O S2 -","- C64 H48 O4 S8 -","4","1","","Sundaravelu, Nallappan; Singha, Tushar; Nandy, Anuradha; Sekar, Govindasamy","Copper-catalyzed domino synthesis of multi-substituted benzo[b]thiophene through radical cyclization using xanthate as a sulfur surrogate.","Chemical communications (Cambridge, England)","2021","57","37","4512","4515","10.1039/d0cc08429h","","","0.71073","MoKα","","0.0473","0.0334","","","0.0785","0.0892","","","","","","1.009","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128059","6.9373","0.0003","9.0024","0.0004","11.0434","0.0005","88.3339","0.0018","86.4577","0.0018","76.6509","0.0016","669.69","0.05","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H10 O2 S2 -","- C16 H10 O2 S2 -","- C32 H20 O4 S4 -","2","1","","Sundaravelu, Nallappan; Singha, Tushar; Nandy, Anuradha; Sekar, Govindasamy","Copper-catalyzed domino synthesis of multi-substituted benzo[b]thiophene through radical cyclization using xanthate as a sulfur surrogate.","Chemical communications (Cambridge, England)","2021","57","37","4512","4515","10.1039/d0cc08429h","","","0.71073","MoKα","","0.0408","0.0365","","","0.1182","0.1279","","","","","","0.951","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128060","9.137","0.0003","9.3396","0.0004","9.341","0.0003","105.238","0.0017","102.339","0.0017","91.2454","0.0018","748.76","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H15 N O S2 -","- C17 H15 N O S2 -","- C34 H30 N2 O2 S4 -","2","1","","Sundaravelu, Nallappan; Singha, Tushar; Nandy, Anuradha; Sekar, Govindasamy","Copper-catalyzed domino synthesis of multi-substituted benzo[b]thiophene through radical cyclization using xanthate as a sulfur surrogate.","Chemical communications (Cambridge, England)","2021","57","37","4512","4515","10.1039/d0cc08429h","","","0.71073","MoKα","","0.0391","0.0328","","","0.0841","0.0914","","","","","","1.036","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128061","25.1867","0.0015","13.4727","0.0008","11.4702","0.0007","90","","111.67","0.001","90","","3617.1","0.4","120","","120","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C43 H34 F3 I P2 Pd -","- C43 H34 F3 I P2 Pd -","- C172 H136 F12 I4 P8 Pd4 -","4","0.5","","Karpov, Gleb O.; Ren, Xiang-Kui; Melnikova, Elizaveta K.; Bermeshev, Maxim V.","Activation of Pd-precatalysts by organic compounds for vinyl-addition polymerization of a norbornene derivative.","Chemical communications (Cambridge, England)","2021","57","35","4255","4258","10.1039/d1cc00546d","","","0.71073","MoKα","","0.0669","0.039","","","0.0755","0.0862","","","","","","1.006","","","","has coordinates","264883","2021-05-05","08:08:33",""
"7128062","26.025","0.008","26.025","0.008","12.283","0.005","90","","90","","90","","8319","5","273","2","273","2","","","","","","","","3","P -4 n 2","P -4 -2n","118","","","","- C148 H120 S16 -","- C148 H120 S16 -","- C296 H240 S32 -","2","0.25","","Basavarajappa, Ashokkumar; Ambhore, Madan D.; Anand, Venkataramanarao G.","Three dimensional isophlorinoid tetrapodal molecular cage.","Chemical communications (Cambridge, England)","2021","57","35","4299","4302","10.1039/d1cc01002f","","","0.71073","MoKα","","0.1277","0.095","","","0.2524","0.2857","","","","","","1.038","","","","has coordinates","264887","2021-05-05","08:10:25",""
"7128063","13.11","0.03","25.03","0.06","28.95","0.07","90","","90.27","0.03","90","","9500","4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C92 H72 S12 -","- C92 H72 S12 -","- C368 H288 S48 -","4","1","","Basavarajappa, Ashokkumar; Ambhore, Madan D.; Anand, Venkataramanarao G.","Three dimensional isophlorinoid tetrapodal molecular cage.","Chemical communications (Cambridge, England)","2021","57","35","4299","4302","10.1039/d1cc01002f","","","0.71073","MoKα","","0.2137","0.1378","","","0.3345","0.3744","","","","","","1.053","","","","has coordinates,has disorder","264887","2021-05-05","08:10:28",""
"7128064","12.9925","0.0002","17.0979","0.0003","19.4724","0.0003","67.218","0.001","77.55","0.001","89.347","0.001","3881.93","0.11","100","0.3","100","0.3","","","","","","","","7","P -1","-P 1","2","","","","- C89 H59 B F24 Fe P2 Ru -","- C89 H59 B F24 Fe P2 Ru -","- C178 H118 B2 F48 Fe2 P4 Ru2 -","2","1","","Korb, Marcus; Moggach, Stephen A.; Low, Paul J.","Synthesis of a diferrocenylvinylidene complex by migration of a ferrocenyl substituent.","Chemical communications (Cambridge, England)","2021","57","35","4251","4254","10.1039/d1cc00605c","","","1.54184","CuKα","","0.0546","0.0499","","","0.1349","0.139","","","","","","1.066","","","","has coordinates","264885","2021-05-05","08:09:25",""
"7128065","10.4117","0.0004","31.4879","0.0016","24.3673","0.0014","90","","92.969","0.004","90","","7977.9","0.7","114.95","0.1","114.95","0.1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C86 H60 B Cl3 F24 Fe2 P2 Ru -","- C86 H60 B Cl3 F24 Fe2 P2 Ru -","- C344 H240 B4 Cl12 F96 Fe8 P8 Ru4 -","4","1","","Korb, Marcus; Moggach, Stephen A.; Low, Paul J.","Synthesis of a diferrocenylvinylidene complex by migration of a ferrocenyl substituent.","Chemical communications (Cambridge, England)","2021","57","35","4251","4254","10.1039/d1cc00605c","","","0.71073","MoKα","","0.1695","0.0832","","","0.1775","0.2202","","","","","","1.023","","","","has coordinates,has disorder","264885","2021-05-05","08:09:33",""
"7128066","37.1212","0.001","12.8085","0.0002","36.2792","0.0007","90","","108.987","0.003","90","","16311.1","0.7","99.9","0.4","99.9","0.4","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C93 H63 B F24 Fe2 P2 Ru -","- C93 H63 B F24 Fe2 P2 Ru -","- C744 H504 B8 F192 Fe16 P16 Ru8 -","8","1","","Korb, Marcus; Moggach, Stephen A.; Low, Paul J.","Synthesis of a diferrocenylvinylidene complex by migration of a ferrocenyl substituent.","Chemical communications (Cambridge, England)","2021","57","35","4251","4254","10.1039/d1cc00605c","","","1.54184","CuKα","","0.097","0.0755","","","0.1834","0.1958","","","","","","1.025","","","","has coordinates,has disorder","264885","2021-05-05","08:09:44",""
"7128067","14.9101","0.0005","16.8933","0.0005","17.7738","0.0006","115.156","0.003","99.515","0.003","97.565","0.002","3892.9","0.3","169.9","0.2","169.9","0.2","","","","","","","","8","P -1","-P 1","2","","","","- C158 H106 B2 Cl6 F48 Fe2 P4 Ru2 -","- C158 H106 B2 Cl6 F48 Fe2 P4 Ru2 -","- C158 H106 B2 Cl6 F48 Fe2 P4 Ru2 -","1","0.5","","Korb, Marcus; Moggach, Stephen A.; Low, Paul J.","Synthesis of a diferrocenylvinylidene complex by migration of a ferrocenyl substituent.","Chemical communications (Cambridge, England)","2021","57","35","4251","4254","10.1039/d1cc00605c","","","0.71073","MoKα","","0.0786","0.0532","","","0.1191","0.1283","","","","","","1.049","","","","has coordinates,has disorder","264885","2021-05-05","08:09:55",""
"7128068","12.9737","0.0001","14.0197","0.0001","18.0024","0.0002","109.885","0.001","100.15","0.001","94.185","0.001","2999.58","0.05","100.2","0.7","100.2","0.7","","","","","","","","7","P -1","-P 1","2","","","","- C64 H41 B F24 O P2 Ru -","- C64 H41 B F24 O P2 Ru -","- C128 H82 B2 F48 O2 P4 Ru2 -","2","1","","Korb, Marcus; Moggach, Stephen A.; Low, Paul J.","Synthesis of a diferrocenylvinylidene complex by migration of a ferrocenyl substituent.","Chemical communications (Cambridge, England)","2021","57","35","4251","4254","10.1039/d1cc00605c","","","1.54184","CuKα","","0.0451","0.0394","","","0.1013","0.1049","","","","","","1.07","","","","has coordinates,has disorder","264885","2021-05-05","08:09:57",""
"7128069","15.6941","0.0001","16.9671","0.0001","17.0957","0.0001","103.166","0.001","114.272","0.001","109.21","0.001","3553.32","0.08","99.9","0.5","99.9","0.5","","","","","","","","8","P -1","-P 1","2","","","","- C76 H55 B F24 Fe O P2 Ru -","- C76 H55 B F24 Fe O P2 Ru -","- C152 H110 B2 F48 Fe2 O2 P4 Ru2 -","2","1","","Korb, Marcus; Moggach, Stephen A.; Low, Paul J.","Synthesis of a diferrocenylvinylidene complex by migration of a ferrocenyl substituent.","Chemical communications (Cambridge, England)","2021","57","35","4251","4254","10.1039/d1cc00605c","","","1.54184","CuKα","","0.0377","0.0333","","","0.0854","0.0877","","","","","","1.062","","","","has coordinates,has disorder","264885","2021-05-05","08:10:00",""
"7128070","12.4788","0.0017","19.2697","0.0019","18.877","0.003","90","","90.694","0.008","90","","4538.9","1.1","100","2","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C49 H44 F15 N5 -","- C49 H44 F15 N5 -","- C196 H176 F60 N20 -","4","1","","Kundu, Gargi; Ajithkumar, V. S.; Bisai, Milan Kumar; Tothadi, Srinu; Das, Tamal; Vanka, Kumar; Sen, Sakya S.","Diverse reactivity of carbenes and silylenes towards fluoropyridines.","Chemical communications (Cambridge, England)","2021","57","36","4428","4431","10.1039/d1cc01401c","","","1.54178","CuKα","","0.0729","0.0637","","","0.1207","0.1279","","","","","","1.068","","","","has coordinates","265890","2021-06-05","17:30:53",""
"7128071","10.7352","0.0003","17.745","0.0005","18.4206","0.0005","90","","100.624","0.002","90","","3448.9","0.17","100","2","99.89","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H38 B Cl2 F8 N3 -","- C31 H38 B Cl1.9999 F8 N3 -","- C124 H152 B4 Cl7.9996 F32 N12 -","4","1","","Kundu, Gargi; Ajithkumar, V. S.; Bisai, Milan Kumar; Tothadi, Srinu; Das, Tamal; Vanka, Kumar; Sen, Sakya S.","Diverse reactivity of carbenes and silylenes towards fluoropyridines.","Chemical communications (Cambridge, England)","2021","57","36","4428","4431","10.1039/d1cc01401c","","","0.71073","MoKα","","0.0665","0.0541","","","0.1427","0.1523","","","","","","1.03","","","","has coordinates,has disorder","265890","2021-06-05","17:30:53",""
"7128072","10.35","0.002","11.9292","0.0018","22.376","0.012","83.095","0.018","83.19","0.02","70.263","0.012","2572.5","1.5","100","2","100","","","","","","","","","5","P -1","-P 1","2","","","","- C57 H51 B F16 N2 -","- C57 H51 B F16 N2 -","- C114 H102 B2 F32 N4 -","2","1","","Kundu, Gargi; Ajithkumar, V. S.; Bisai, Milan Kumar; Tothadi, Srinu; Das, Tamal; Vanka, Kumar; Sen, Sakya S.","Diverse reactivity of carbenes and silylenes towards fluoropyridines.","Chemical communications (Cambridge, England)","2021","57","36","4428","4431","10.1039/d1cc01401c","","","0.71073","MoKα","","0.078","0.062","","","0.1476","0.1551","","","","","","1.096","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128073","15.6778","0.0015","19.214","0.002","26.77","0.003","90","","105.888","0.003","90","","7756","1.4","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C65 H85 Cl12 F8 N5 Si -","- C65 H85 Cl12 F8 N5 Si -","- C260 H340 Cl48 F32 N20 Si4 -","4","1","","Kundu, Gargi; Ajithkumar, V. S.; Bisai, Milan Kumar; Tothadi, Srinu; Das, Tamal; Vanka, Kumar; Sen, Sakya S.","Diverse reactivity of carbenes and silylenes towards fluoropyridines.","Chemical communications (Cambridge, England)","2021","57","36","4428","4431","10.1039/d1cc01401c","","","0.71073","MoKα","","0.1095","0.0855","","","0.2118","0.2297","","","","","","1.063","","","","has coordinates,has disorder","265890","2021-06-05","17:30:53",""
"7128074","24.4829","0.001","13.9216","0.0007","42.4462","0.0019","90","","90","","90","","14467.4","1.1","100","2","100","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C29 H50 F5 N3 Si5 -","- C29 H50 F5 N3 Si5 -","- C464 H800 F80 N48 Si80 -","16","2","","Kundu, Gargi; Ajithkumar, V. S.; Bisai, Milan Kumar; Tothadi, Srinu; Das, Tamal; Vanka, Kumar; Sen, Sakya S.","Diverse reactivity of carbenes and silylenes towards fluoropyridines.","Chemical communications (Cambridge, England)","2021","57","36","4428","4431","10.1039/d1cc01401c","","","0.71073","MoKα","","0.0512","0.0425","","","0.0972","0.1014","","","","","","1.145","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128075","6.8571","0.0008","9.7204","0.0011","10.0406","0.001","64.131","0.01","88.185","0.009","86.345","0.01","600.95","0.13","120","0.1","120","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C11 H8 Mo N4 O3 -","- C11 H8 Mo N4 O3 -","- C22 H16 Mo2 N8 O6 -","2","1","","Voigt, Laura; Wugt Larsen, René; Kubus, Mariusz; Pedersen, Kasper S.","Zero-valent metals in metal-organic frameworks: fac-M(CO)<sub>3</sub>(pyrazine)<sub>3/2</sub>.","Chemical communications (Cambridge, England)","2021","57","32","3861","3864","10.1039/d1cc00864a","","x-ray","0.71073","MoKα","","0.0572","0.0361","","","0.064","0.0672","","","","","","0.868","","","","has coordinates","264865","2021-05-05","08:02:46",""
"7128076","16.13834","0.00017","16.13834","0.00017","16.13834","0.00017","90","","90","","90","","4203.17","0.08","120","0.1","120","0.1","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C9 H6 N3 O3 W -","- C9 H6 N3 O3 W -","- C144 H96 N48 O48 W16 -","16","0.333333","","Voigt, Laura; Wugt Larsen, René; Kubus, Mariusz; Pedersen, Kasper S.","Zero-valent metals in metal-organic frameworks: fac-M(CO)<sub>3</sub>(pyrazine)<sub>3/2</sub>.","Chemical communications (Cambridge, England)","2021","57","32","3861","3864","10.1039/d1cc00864a","","x-ray","0.71073","MoKα","","0.0232","0.017","","","0.0238","0.0252","","","","","","1.113","","","","has coordinates","264865","2021-05-05","08:02:46",""
"7128077","16.2253","0.0005","16.2253","0.0005","16.2253","0.0005","90","","90","","90","","4271.5","0.2","120","0.1","120","0.1","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C9 H6 Mo N3 O3 -","- C9 H6 Mo N3 O3 -","- C144 H96 Mo16 N48 O48 -","16","0.333333","","Voigt, Laura; Wugt Larsen, René; Kubus, Mariusz; Pedersen, Kasper S.","Zero-valent metals in metal-organic frameworks: fac-M(CO)<sub>3</sub>(pyrazine)<sub>3/2</sub>.","Chemical communications (Cambridge, England)","2021","57","32","3861","3864","10.1039/d1cc00864a","","x-ray","0.71073","MoKα","","0.0426","0.0305","","","0.0484","0.0546","","","","","","1.071","","","","has coordinates","264865","2021-05-05","08:02:46",""
"7128078","15.8757","0.0006","15.8757","0.0006","15.8757","0.0006","90","","90","","90","","4001.3","0.3","119.99","0.1","119.99","0.1","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C9 H6 Cr N3 O3 -","- C9 H6 Cr N3 O3 -","- C144 H96 Cr16 N48 O48 -","16","0.333333","","Voigt, Laura; Wugt Larsen, René; Kubus, Mariusz; Pedersen, Kasper S.","Zero-valent metals in metal-organic frameworks: fac-M(CO)<sub>3</sub>(pyrazine)<sub>3/2</sub>.","Chemical communications (Cambridge, England)","2021","57","32","3861","3864","10.1039/d1cc00864a","","x-ray","0.71073","MoKα","","0.0436","0.0359","","","0.0726","0.0766","","","","","","1.107","","","","has coordinates","264865","2021-05-05","08:02:46",""
"7128079","17.8974","0.0007","9.9861","0.0005","6.7067","0.0003","90","","90.482","0.004","90","","1198.61","0.09","120","0.1","120","0.1","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C9 H6 N3 O3 W -","- C8.9998 H5.9998 N3 O3 W -","- C35.9992 H23.9992 N12 O12 W4 -","4","0.5","","Voigt, Laura; Wugt Larsen, René; Kubus, Mariusz; Pedersen, Kasper S.","Zero-valent metals in metal-organic frameworks: fac-M(CO)<sub>3</sub>(pyrazine)<sub>3/2</sub>.","Chemical communications (Cambridge, England)","2021","57","32","3861","3864","10.1039/d1cc00864a","","x-ray","0.71073","MoKα","","0.0216","0.0215","","","0.0421","0.0422","","","","","","1.012","","","","has coordinates,has disorder","264865","2021-05-05","08:02:46",""
"7128080","14.0215","0.0004","15.7562","0.0004","25.1672","0.0006","90.777","0.002","91.477","0.002","105.027","0.002","5367","0.2","173","0.1","173","0.1","","","","","","","","9","P -1","-P 1","2","","","","- C213 H190 Cl10 Cu16 F12 N12 O12 P12 S4 -","- C213 H190 Cl10 Cu16 F12 N12 O12 P12 S4 -","- C213 H190 Cl10 Cu16 F12 N12 O12 P12 S4 -","1","0.5","","Yuan, Shang-Fu; Luyang, Heng-Wang; Lei, Zhen; Wan, Xian-Kai; Li, Jiao-Jiao; Wang, Quan-Ming","A stable well-defined copper hydride cluster consolidated with hemilabile phosphines.","Chemical communications (Cambridge, England)","2021","57","35","4315","4318","10.1039/d1cc01161h","","","1.54178","CuKα","","0.0849","0.0672","","","0.1637","0.1784","","","","","","1.021","","","","has coordinates","264886","2021-05-05","08:10:13",""
"7128081","8.9295","0.0002","9.7179","0.0001","17.1819","0.0001","94.114","0.001","90.034","0.001","101.369","0.001","1457.79","0.04","199","2","199","2","","","","","","","","6","P -1","-P 1","2","[Cp*Os(PCy3)H4][BF4]","","","- C28 H52 B F4 Os P -","- C28 H52 B F4 Os P -","- C56 H104 B2 F8 Os2 P2 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0414","0.0333","","","0.0648","0.0681","","","","","","1.6518","","","","has coordinates","264873","2021-05-05","08:06:26",""
"7128082","9.6397","0.0012","10.441","0.0013","18.381","0.002","102.148","0.015","94.667","0.015","107.402","0.014","1705","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dicarbonyl-cis-dihydrido-trans-bis(triphenylphosphite)iron(II)","","- C38 H32 Fe O8 P2 -","- C38 H32 Fe O8 P2 -","- C76 H64 Fe2 O16 P4 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0299","0.0197","","","0.0321","0.0332","","","","","","1.2186","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128083","8.9295","0.0002","9.7179","0.0001","17.1819","0.0001","94.114","0.001","90.034","0.001","101.369","0.001","1457.79","0.04","199","2","199","2","","","","","","","","6","P -1","-P 1","2","[Cp*Os(PCy3)H4][BF4]","","","- C28 H52 B F4 Os P -","- C28 H52 B F4 Os P -","- C56 H104 B2 F8 Os2 P2 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0415","0.0335","","","0.0737","0.0808","","","","","","1.0734","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128084","9.6397","0.0012","10.441","0.0013","18.381","0.002","102.148","0.015","94.667","0.015","107.402","0.014","1705","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H32 Fe O8 P2 -","- C38 H32 Fe O8 P2 -","- C76 H64 Fe2 O16 P4 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0305","0.0204","","","0.0338","0.0348","","","","","","1.2567","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128085","9.6397","0.0012","10.441","0.0013","18.381","0.002","102.148","0.015","94.667","0.015","107.402","0.014","1705","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dicarbonyl-cis-dihydrido-trans-bis(triphenylphosphite)iron(II)","","- C38 H32 Fe O8 P2 -","- C38 H32 Fe O8 P2 -","- C76 H64 Fe2 O16 P4 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0286","0.0186","","","0.0365","0.0386","","","","","","0.9641","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128086","9.6397","0.0012","10.441","0.0013","18.381","0.002","102.148","0.015","94.667","0.015","107.402","0.014","1705","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dicarbonyl-cis-dihydrido-trans-bis(triphenylphosphite)iron(II)","","- C38 H32 Fe O8 P2 -","- C38 H32 Fe O8 P2 -","- C76 H64 Fe2 O16 P4 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0301","0.02","","","0.033","0.0341","","","","","","1.2298","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128087","9.6397","0.0012","10.441","0.0013","18.381","0.002","102.148","0.015","94.667","0.015","107.402","0.014","1705","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dicarbonyl-cis-dihydrido-trans-bis(triphenylphosphite)iron(II)","","- C38 H32 Fe O8 P2 -","- C38 H32 Fe O8 P2 -","- C76 H64 Fe2 O16 P4 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0372","0.0268","","","0.0657","0.0692","","","","","","0.9963","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128088","9.6397","0.0012","10.441","0.0013","18.381","0.002","102.148","0.015","94.667","0.015","107.402","0.014","1705","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dicarbonyl-cis-dihydrido-trans-bis(triphenylphosphite)iron(II)","","- C38 H32 Fe O8 P2 -","- C38 H32 Fe O8 P2 -","- C76 H64 Fe2 O16 P4 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0298","0.0196","","","0.0318","0.0329","","","","","","1.2082","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128089","11.228","0.003","11.101","0.003","23.414","0.007","90","","102.28","0.04","90","","2851.6","1.4","120","2","120.15","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H47 B Cl O2 P2 Rh -","- C24 H47 B Cl O2 P2 Rh -","- C96 H188 B4 Cl4 O8 P8 Rh4 -","4","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0292","0.0256","","","0.0556","0.0577","","","","","","1.0595","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128090","11.228","0.003","11.101","0.003","23.414","0.007","90","","102.28","0.04","90","","2851.6","1.4","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H47 B Cl O2 P2 Rh -","- C24 H47 B Cl O2 P2 Rh -","- C96 H188 B4 Cl4 O8 P8 Rh4 -","4","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0251","0.0215","","","0.0281","0.0286","","","","","","1.7281","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128091","9.6397","0.0012","10.441","0.0013","18.381","0.002","102.148","0.015","94.667","0.015","107.402","0.014","1705","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dicarbonyl-cis-dihydrido-trans-bis(triphenylphosphite-O)-iron(ii)","","- C38 H32 Fe O8 P2 -","- C38 H32 Fe O8 P2 -","- C76 H64 Fe2 O16 P4 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0288","0.0187","","","0.0369","0.0389","","","","","","0.9683","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128092","9.3827","0.0002","18.4666","0.0005","18.9153","0.0005","90","","92.516","0.001","90","","3274.23","0.14","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H55 N9 Ru Si3 -","- C27 H55 N9 Ru Si3 -","- C108 H220 N36 Ru4 Si12 -","4","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0329","0.0208","","","0.0293","0.034","","","","","","0.9668","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128093","13.9065","0.0003","12.1742","0.0003","18.3076","0.0004","90","","94.385","0.002","90","","3090.41","0.12","100","2","100","2","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C56 H53 B F24 N6 Ru Si3 -","- C56 H53 B F24 N6 Ru Si3 -","- C112 H106 B2 F48 N12 Ru2 Si6 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0457","0.0356","","","0.0763","0.0839","","","","","","1.0648","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128094","9.3827","0.0002","18.4666","0.0005","18.9153","0.0005","90","","92.516","0.001","90","","3274.23","0.14","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H55 N9 Ru Si3 -","- C27 H55 N9 Ru Si3 -","- C108 H220 N36 Ru4 Si12 -","4","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0383","0.0261","","","0.0566","0.0627","","","","","","1.012","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128095","13.9065","0.0003","12.1742","0.0003","18.3076","0.0004","90","","94.385","0.002","90","","3090.41","0.12","100","2","100","2","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C56 H53 B F24 N6 Ru Si3 -","- C56 H53 B F24 N6 Ru Si3 -","- C112 H106 B2 F48 N12 Ru2 Si6 -","2","1","","Woińska, Magdalena; Chodkiewicz, Michał L; Woźniak, Krzysztof","Towards accurate and precise positions of hydrogen atoms bonded to heavy metal atoms.","Chemical communications (Cambridge, England)","2021","57","30","3652","3655","10.1039/d0cc07661a","","","0.71073","MoKα","","0.0482","0.0382","","","0.0845","0.0924","","","","","","1.0579","","","","has coordinates","264873","2021-05-05","08:06:27",""
"7128096","5.2298","0.0004","20.4052","0.0011","11.804","0.001","90","","102.895","0.008","90","","1227.9","0.16","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H10 Cl N O -","- C15 H10 Cl N O -","- C60 H40 Cl4 N4 O4 -","4","1","","Liu, Jin-Biao; Ren, Miaofeng; Lai, Xiaojing; Qiu, Guanyinsheng","Iron-catalyzed stereoselective haloamidation of amide-tethered alkynes.","Chemical communications (Cambridge, England)","2021","57","35","4259","4262","10.1039/d1cc00870f","","x-ray","0.71073","MoKα","","0.0504","0.0377","","","0.0866","0.0937","","","","","","1.031","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128097","21.9496","0.0003","21.9496","0.0003","7.9389","0.0002","90","","90","","90","","3824.84","0.12","170","0.1","170","0.1","","","","","","","","4","P 42/n :2","-P 4bc","86","","","","- C25 H19 N O -","- C25 H19 N O -","- C200 H152 N8 O8 -","8","1","","Bi, Weiyang; Yang, Yunhui; Ye, Song; Wang, Congyang","Umpolung coupling of pyridine-2-carboxaldehydes and propargylic carbonates <i>via</i> N-heterocyclic carbene/palladium synergetic catalysis.","Chemical communications (Cambridge, England)","2021","57","36","4452","4455","10.1039/d1cc01311d","","x-ray","0.71073","MoKα","","0.0533","0.0438","","","0.1135","0.1189","","","","","","1.038","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128098","13.2176","0.0004","16.9304","0.0004","16.1942","0.0004","90","","91.781","0.002","90","","3622.18","0.17","100.01","0.1","100.01","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C5 H30 K3 Mn Na3 O36 W6 -","- C5 H30 K3 Mn Na3 O36 W6 -","- C20 H120 K12 Mn4 Na12 O144 W24 -","4","1","","Li, Qi; Wei, Yongge","Unprecedented monofunctionalized β-Anderson clusters: [R<sub>1</sub>R<sub>2</sub>C(CH<sub>2</sub>O)<sub>2</sub>Mn<sup>IV</sup>W<sub>6</sub>O<sub>22</sub>]<sup>6-</sup>, a class of potential candidates for new inorganic linkers.","Chemical communications (Cambridge, England)","2021","57","32","3865","3868","10.1039/d1cc00563d","","x-ray","0.71073","MoKα","","0.0325","0.0269","","","0.0496","0.0519","","","","","","1.053","","","","has coordinates","264866","2021-05-05","08:03:07",""
"7128099","16.8017","0.0009","12.0565","0.0007","17.3015","0.001","90","","98.226","0.005","90","","3468.7","0.3","100","0.1","100","0.1","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C4 H29.5 K3.5 Mn N Na1.5 O34.75 W6 -","- C4 H10 K3.5 Mn N Na1.5 O34.75 W6 -","- C16 H40 K14 Mn4 N4 Na6 O139 W24 -","4","1","","Li, Qi; Wei, Yongge","Unprecedented monofunctionalized β-Anderson clusters: [R<sub>1</sub>R<sub>2</sub>C(CH<sub>2</sub>O)<sub>2</sub>Mn<sup>IV</sup>W<sub>6</sub>O<sub>22</sub>]<sup>6-</sup>, a class of potential candidates for new inorganic linkers.","Chemical communications (Cambridge, England)","2021","57","32","3865","3868","10.1039/d1cc00563d","","x-ray","0.71073","MoKα","","0.0688","0.0508","","","0.1019","0.1123","","","","","","1.066","","","","has coordinates,has disorder","264866","2021-05-05","08:03:08",""
"7128100","11.2401","0.0008","12.3767","0.001","13.7509","0.0011","87.069","0.007","89.529","0.006","69.663","0.007","1791.3","0.3","109.7","0.7","109.7","0.7","","","","","","","","9","P -1","-P 1","2","","","","- C8 H61 Ag K7 Mn2 N2 Na2 O70.5 W12 -","- C8 H20 Ag K7 Mn2 N2 Na2 O70.5 W12 -","- C8 H20 Ag K7 Mn2 N2 Na2 O70.5 W12 -","1","0.5","","Li, Qi; Wei, Yongge","Unprecedented monofunctionalized β-Anderson clusters: [R<sub>1</sub>R<sub>2</sub>C(CH<sub>2</sub>O)<sub>2</sub>Mn<sup>IV</sup>W<sub>6</sub>O<sub>22</sub>]<sup>6-</sup>, a class of potential candidates for new inorganic linkers.","Chemical communications (Cambridge, England)","2021","57","32","3865","3868","10.1039/d1cc00563d","","x-ray","1.54184","CuKα","","0.0604","0.0485","","","0.1246","0.1356","","","","","","1.033","","","","has coordinates,has disorder","264866","2021-05-05","08:03:08",""
"7128101","16.7373","0.0006","12.0905","0.0004","17.2671","0.0005","90","","98.832","0.003","90","","3452.8","0.2","100","0.1","100","0.1","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C4 H28 K3.67 Mn N Na1.33 O33 W6 -","- C4 H10 K3.66665 Mn N Na1.3333 O33 W6 -","- C16 H40 K14.6666 Mn4 N4 Na5.3332 O132 W24 -","4","1","","Li, Qi; Wei, Yongge","Unprecedented monofunctionalized β-Anderson clusters: [R<sub>1</sub>R<sub>2</sub>C(CH<sub>2</sub>O)<sub>2</sub>Mn<sup>IV</sup>W<sub>6</sub>O<sub>22</sub>]<sup>6-</sup>, a class of potential candidates for new inorganic linkers.","Chemical communications (Cambridge, England)","2021","57","32","3865","3868","10.1039/d1cc00563d","","x-ray","0.71073","MoKα","","0.0402","0.0337","","","0.0811","0.0859","","","","","","1.07","","","","has coordinates,has disorder","264866","2021-05-05","08:03:08",""
"7128102","10.2889","0.0003","10.7488","0.0003","18.3923","0.0006","95.613","0.003","97.191","0.003","111.82","0.003","1850.34","0.11","100.01","0.13","100.01","0.13","","","","","","","","7","P -1","-P 1","2","","","","- C6 H28 K4 Mn Na2 O33 W6 -","- C6 H12 K4 Mn Na2 O33 W6 -","- C12 H24 K8 Mn2 Na4 O66 W12 -","2","1","","Li, Qi; Wei, Yongge","Unprecedented monofunctionalized β-Anderson clusters: [R<sub>1</sub>R<sub>2</sub>C(CH<sub>2</sub>O)<sub>2</sub>Mn<sup>IV</sup>W<sub>6</sub>O<sub>22</sub>]<sup>6-</sup>, a class of potential candidates for new inorganic linkers.","Chemical communications (Cambridge, England)","2021","57","32","3865","3868","10.1039/d1cc00563d","","x-ray","0.71073","MoKα","","0.0595","0.0511","","","0.1133","0.1169","","","","","","1.16","","","","has coordinates,has disorder","264866","2021-05-05","08:03:08",""
"7128103","10.1464","0.0006","13.158","0.0009","14.54","0.0011","77.1","0.003","79.36","0.003","79.807","0.003","1840.9","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H30 Fe2 K2 N12 O4 -","- C36 H30 Fe2 K2 N12 O4 -","- C72 H60 Fe4 K4 N24 O8 -","2","1","","Vittardi, Sebastian B.; Magar, Rajani Thapa; Schrage, Briana R.; Ziegler, Christopher J.; Jakubikova, Elena; Rack, Jeffrey J.","Evidence for a lowest energy <sup>3</sup>MLCT excited state in [Fe(tpy)(CN)<sub>3</sub>]<sup/>.","Chemical communications (Cambridge, England)","2021","57","38","4658","4661","10.1039/d1cc01090e","","","0.71073","MoKα","","0.0284","0.0237","","","0.0624","0.0639","","","","","","1.036","","","","has coordinates","265906","2021-06-05","17:34:19",""
"7128104","16.823","0.002","6.4449","0.0009","16.163","0.002","90","","111.306","0.004","90","","1632.7","0.4","273","2","273.15","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- Ag Ga6 Rb S10 -","- Ag Ga6 Rb S10 -","- Ag4 Ga24 Rb4 S40 -","4","1","","Li, Jia-Nuo; Li, Xiao-Hui; Yao, Wen-Dong; Liu, Wenlong; Guo, Sheng-Ping","New nonlinear optical-active AAgGa<sub>6</sub>S<sub>10</sub> (A = K, Rb, Cs) featuring {[AgGa<sub>6</sub>S<sub>10</sub>]<sup>-</sup>}<sub>\ιnfty </sub> framework and high laser damage threshold.","Chemical communications (Cambridge, England)","2021","57","42","5175","5178","10.1039/d1cc01275d","","","0.71073","MoKα","","0.0216","0.0207","","","0.0412","0.0416","","","","","","0.955","","","","has coordinates","265869","2021-06-05","17:26:12",""
"7128105","16.8278","0.0011","6.4318","0.0004","16.1146","0.001","90","","111.293","0.002","90","","1625.07","0.18","273","2","273.15","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- Ag Ga6 K S10 -","- Ag Ga6 K S10 -","- Ag4 Ga24 K4 S40 -","4","1","","Li, Jia-Nuo; Li, Xiao-Hui; Yao, Wen-Dong; Liu, Wenlong; Guo, Sheng-Ping","New nonlinear optical-active AAgGa<sub>6</sub>S<sub>10</sub> (A = K, Rb, Cs) featuring {[AgGa<sub>6</sub>S<sub>10</sub>]<sup>-</sup>}<sub>\ιnfty </sub> framework and high laser damage threshold.","Chemical communications (Cambridge, England)","2021","57","42","5175","5178","10.1039/d1cc01275d","","","0.71073","MoKα","","0.0119","0.0117","","","0.0283","0.0284","","","","","","0.836","","","","has coordinates","265869","2021-06-05","17:26:12",""
"7128106","16.8381","0.0006","6.4655","0.0003","16.2525","0.0006","90","","111.281","0.001","90","","1648.71","0.11","273","2","273.15","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- Ag Cs Ga6 S10 -","- Ag Cs Ga6 S10 -","- Ag4 Cs4 Ga24 S40 -","4","1","","Li, Jia-Nuo; Li, Xiao-Hui; Yao, Wen-Dong; Liu, Wenlong; Guo, Sheng-Ping","New nonlinear optical-active AAgGa<sub>6</sub>S<sub>10</sub> (A = K, Rb, Cs) featuring {[AgGa<sub>6</sub>S<sub>10</sub>]<sup>-</sup>}<sub>\ιnfty </sub> framework and high laser damage threshold.","Chemical communications (Cambridge, England)","2021","57","42","5175","5178","10.1039/d1cc01275d","","","0.71073","MoKα","","0.016","0.0157","","","0.0372","0.0374","","","","","","0.831","","","","has coordinates","265869","2021-06-05","17:26:12",""
"7128107","7.2496","0.0001","16.9896","0.0003","16.7783","0.0003","90","","90.742","0.001","90","","2066.37","0.06","100.01","0.16","100.01","0.16","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H23 N O2 -","- C27 H23 N O2 -","- C108 H92 N4 O8 -","4","1","","Manning, Morgan A.; Sun, Wei; Light, Mark E.; Harrowven, David C.","A photochemical ring expansion of 6- to 8-membered nitrogen heterocycles by [1,3]-sigmatropic rearrangement.","Chemical communications (Cambridge, England)","2021","57","37","4556","4559","10.1039/d1cc00393c","","x-ray","0.71073","MoKα","","0.0511","0.0461","","","0.1074","0.111","","","","","","1.05","","","","has coordinates","301860","2025-08-22","09:27:02",""
"7128108","8.7874","0.0002","17.8436","0.0004","31.3137","0.0006","97.518","0.002","90.336","0.002","92.213","0.002","4863.82","0.18","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H29 N O5 -","- C30 H29 N O5 -","- C240 H232 N8 O40 -","8","4","","Manning, Morgan A.; Sun, Wei; Light, Mark E.; Harrowven, David C.","A photochemical ring expansion of 6- to 8-membered nitrogen heterocycles by [1,3]-sigmatropic rearrangement.","Chemical communications (Cambridge, England)","2021","57","37","4556","4559","10.1039/d1cc00393c","","x-ray","0.71073","MoKα","","0.1475","0.1215","","","0.2961","0.3138","","","","","","1.136","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128109","8.3579","0.0008","13.8057","0.0013","19.3031","0.0019","90","","90","","90","","2227.3","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H24 Cl N O2 -","- C28 H24 Cl N O2 -","- C112 H96 Cl4 N4 O8 -","4","1","","Xiao, Jun-An; Li, Jin-Lian; Cheng, Xiu-Liang; Chen, Kai; Peng, Hai; Chen, Wen-Qiang; Su, Wei; Huang, Yan-Min; Yang, Hua","Enantioselective formal [3+2]-cycloadditions to access spirooxindoles bearing four contiguous stereocenters through synergistic catalysis.","Chemical communications (Cambridge, England)","2021","57","36","4456","4459","10.1039/d0cc07957j","","","0.71076","MoKα","","0.0893","0.0503","","","0.1001","0.1124","","","","","","1.021","","","","has coordinates","298703","2025-04-03","05:34:20",""
"7128110","9.517","0.0005","16","0.0008","14.7989","0.0008","90","","97.614","0.002","90","","2233.6","0.2","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 Cl N O2 -","- C28 H24 Cl N O2 -","- C112 H96 Cl4 N4 O8 -","4","1","","Xiao, Jun-An; Li, Jin-Lian; Cheng, Xiu-Liang; Chen, Kai; Peng, Hai; Chen, Wen-Qiang; Su, Wei; Huang, Yan-Min; Yang, Hua","Enantioselective formal [3+2]-cycloadditions to access spirooxindoles bearing four contiguous stereocenters through synergistic catalysis.","Chemical communications (Cambridge, England)","2021","57","36","4456","4459","10.1039/d0cc07957j","","","","","","0.131","","","","","","","","","","","","","","","has coordinates","298703","2025-04-03","05:34:20",""
"7128111","8.6247","0.0004","14.035","0.0006","19.2606","0.0009","90","","90","","90","","2331.45","0.18","297","2","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H27 N O3 -","- C29 H27 N O3 -","- C116 H108 N4 O12 -","4","1","","Xiao, Jun-An; Li, Jin-Lian; Cheng, Xiu-Liang; Chen, Kai; Peng, Hai; Chen, Wen-Qiang; Su, Wei; Huang, Yan-Min; Yang, Hua","Enantioselective formal [3+2]-cycloadditions to access spirooxindoles bearing four contiguous stereocenters through synergistic catalysis.","Chemical communications (Cambridge, England)","2021","57","36","4456","4459","10.1039/d0cc07957j","","","1.54178","CuKα","","0.0537","0.0461","","","0.1211","0.1285","","","","","","1.025","","","","has coordinates","298328","2025-03-07","16:31:39",""
"7128112","7.6547","0.0001","8.3977","0.0002","21.0738","0.0004","90","","90","","90","","1354.66","0.04","292.62","0.1","292.62","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H10 F3 N3 O -","- C14 H10 F3 N3 O -","- C56 H40 F12 N12 O4 -","4","1","","Tu, Youshao; Dong, Honglin; Wang, Huamin; Ao, Yuhui; Liu, Yu","Divergent functionalization of α,β-enones: catalyst-free access to β-azido ketones and β-amino α-diazo ketones.","Chemical communications (Cambridge, England)","2021","57","37","4524","4527","10.1039/d1cc00985k","","x-ray","1.54184","CuKα","","0.0314","0.0302","","","0.0831","0.0842","","","","","","1.082","","","","has coordinates","265844","2021-06-05","17:18:13",""
"7128113","4.1258","0.0002","22.7811","0.0008","11.805","0.0007","90","","93.599","0.001","90","","1107.37","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H8 F N O3 -","- C13 H8 F N O3 -","- C52 H32 F4 N4 O12 -","4","1","","Wu, Qiuzi; Mao, Yang-Jie; Zhou, Kun; Wang, Shuang; Chen, Lei; Xu, Zhen-Yuan; Lou, Shao-Jie; Xu, Dan-Qian","Pd-Catalysed direct C(sp<sup>2</sup>)-H fluorination of aromatic ketones: concise access to anacetrapib.","Chemical communications (Cambridge, England)","2021","57","37","4544","4547","10.1039/d1cc01047f","","","0.71073","MoKα","","0.0538","0.0451","","","0.1156","0.1251","","","","","","1.037","","","","has coordinates,has disorder","265843","2021-06-05","17:18:07",""
"7128114","8.206","0.0008","6.9192","0.0006","22.42","0.002","90","","90","","90","","1273","0.2","190","2","190","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C15 H13 F O2 -","- C15 H13 F O2 -","- C60 H52 F4 O8 -","4","0.5","","Wu, Qiuzi; Mao, Yang-Jie; Zhou, Kun; Wang, Shuang; Chen, Lei; Xu, Zhen-Yuan; Lou, Shao-Jie; Xu, Dan-Qian","Pd-Catalysed direct C(sp<sup>2</sup>)-H fluorination of aromatic ketones: concise access to anacetrapib.","Chemical communications (Cambridge, England)","2021","57","37","4544","4547","10.1039/d1cc01047f","","","0.71073","MoKα","","0.0616","0.0429","","","0.114","0.1351","","","","","","1.044","","","","has coordinates","265843","2021-06-05","17:18:07",""
"7128115","11.934","0.008","12.68","0.008","15.587","0.011","83.19","0.02","70.854","0.015","69.918","0.019","2093","2","173","2","172.99","","","","","","","","","3","P -1","-P 1","2","","","","- C90 H72 O12 -","- C90 H72 O12 -","- C90 H72 O12 -","1","0.5","","Zhu, Dingsheng; Fang, Shuai; Tong, Lu; Lei, Ye; Wu, Guangcheng; Chudhary, Tayba; Li, Hao","A cylinder-shaped macrocycle formed <i>via</i> Friedel-Crafts reaction.","Chemical communications (Cambridge, England)","2021","57","36","4440","4443","10.1039/d1cc00498k","","","1.34139","GaKα","","0.2391","0.1412","","","0.3542","0.4399","","","","","","1.016","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128116","10.6599","0.0007","24.9103","0.0015","11.7016","0.0008","90","","113.683","0.002","90","","2845.6","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H26 N2 Te2 -","- C32 H26 N2 Te2 -","- C128 H104 N8 Te8 -","4","1","","Dhaka, Arun; Jeannin, Olivier; Aubert, Emmanuel; Espinosa, Enrique; Fourmigué, Marc","Supramolecular rectangles through directional chalcogen bonding.","Chemical communications (Cambridge, England)","2021","57","37","4560","4563","10.1039/d1cc00789k","","x-ray","0.71073","MoKα","","0.0912","0.0501","","","0.1025","0.118","","","","","","1.023","","","","has coordinates","265842","2021-06-05","17:17:59",""
"7128117","10.8282","0.0019","24.258","0.004","11.763","0.002","90","","115.48","0.006","90","","2789.3","0.8","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H22 N4 Te2 -","- C30 H22 N4 Te2 -","- C120 H88 N16 Te8 -","4","1","","Dhaka, Arun; Jeannin, Olivier; Aubert, Emmanuel; Espinosa, Enrique; Fourmigué, Marc","Supramolecular rectangles through directional chalcogen bonding.","Chemical communications (Cambridge, England)","2021","57","37","4560","4563","10.1039/d1cc00789k","","x-ray","0.71073","MoKα","","0.099","0.0776","","","0.1612","0.1725","","","","","","1.24","","","","has coordinates","265842","2021-06-05","17:18:00",""
"7128118","18.3874","0.0006","10.4516","0.0003","32.5186","0.001","90","","104.148","0.002","90","","6059.8","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 N4 Te2 -","- C34 H30 N4 Te2 -","- C272 H240 N32 Te16 -","8","2","","Dhaka, Arun; Jeannin, Olivier; Aubert, Emmanuel; Espinosa, Enrique; Fourmigué, Marc","Supramolecular rectangles through directional chalcogen bonding.","Chemical communications (Cambridge, England)","2021","57","37","4560","4563","10.1039/d1cc00789k","","x-ray","0.71073","MoKα","","0.1225","0.0576","","","0.1163","0.1393","","","","","","1.018","","","","has coordinates","265842","2021-06-05","17:18:00",""
"7128119","10.39","0.002","11.252","0.002","16.357","0.004","98.128","0.007","91.282","0.007","96.44","0.007","1879.7","0.7","300","2","300","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H34 N4 Te2 -","- C44 H34 N4 Te2 -","- C88 H68 N8 Te4 -","2","1","","Dhaka, Arun; Jeannin, Olivier; Aubert, Emmanuel; Espinosa, Enrique; Fourmigué, Marc","Supramolecular rectangles through directional chalcogen bonding.","Chemical communications (Cambridge, England)","2021","57","37","4560","4563","10.1039/d1cc00789k","","x-ray","0.71073","MoKα","","0.0867","0.0463","","","0.1113","0.1355","","","","","","1.019","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128120","11.6422","0.0005","10.9274","0.0006","35.29","0.002","90","","94.919","0.005","90","","4473","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H21 N O S -","- C29 H21 N O S -","- C232 H168 N8 O8 S8 -","8","2","","Dai, Longji; Yuan, Jianjun; Wu, Cui; Chen, Zhiyuan","Pd-Catalyzed double carbopalladation/<i>syn</i>-insertion cascade reactions toward medium-size sulfoximine heterocycles.","Chemical communications (Cambridge, England)","2021","57","35","4271","4274","10.1039/d1cc00846c","","","0.71073","MoKα","","0.0653","0.0526","","","0.1259","0.1319","","","","","","1.07","","","","has coordinates","294326","2024-09-02","09:37:26",""
"7128121","5.7119","0.0003","11.2727","0.0007","14.3335","0.0008","72.075","0.002","83.916","0.002","83.801","0.002","870.39","0.09","170","","170","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H16 F N O2 -","- C23 H16 F N O2 -","- C46 H32 F2 N2 O4 -","2","1","","Zhou, Fei; Li, Can; Li, Meng; Jin, Yangbin; Jiang, Huanfeng; Zhang, Yingjun; Wu, Wanqing","Synthesis of 2-isoxazolyl-2,3-dihydrobenzofurans <i>via</i> palladium-catalyzed cascade cyclization of alkenyl ethers.","Chemical communications (Cambridge, England)","2021","57","39","4799","4802","10.1039/d1cc00709b","","","0.71073","MoKα","","0.0863","0.0526","","","0.1046","0.1204","","","","","","1.077","","","","has coordinates,has disorder","265878","2021-06-05","17:27:31",""
"7128122","5.8481","0.0005","20.1032","0.0017","15.8952","0.0016","90","","99.844","0.003","90","","1841.2","0.3","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H19 N O2 -","- C24 H19 N O2 -","- C96 H76 N4 O8 -","4","1","","Zhou, Fei; Li, Can; Li, Meng; Jin, Yangbin; Jiang, Huanfeng; Zhang, Yingjun; Wu, Wanqing","Synthesis of 2-isoxazolyl-2,3-dihydrobenzofurans <i>via</i> palladium-catalyzed cascade cyclization of alkenyl ethers.","Chemical communications (Cambridge, England)","2021","57","39","4799","4802","10.1039/d1cc00709b","","","0.71073","MoKα","","0.16","0.0633","","","0.1145","0.1535","","","","","","1.057","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128123","22.788","0.005","24.181","0.005","29.737","0.006","90","","112.337","0.003","90","","15157","6","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C74 H206 Ge18 O2 Si24 Sm -","- C74 H206 Ge18 O2 Si24 Sm -","- C296 H824 Ge72 O8 Si96 Sm4 -","4","1","","Klementyeva, Svetlana V.; Schrenk, Claudio; Zhang, Minghui; Khusniyarov, Marat M.; Schnepf, Andreas","(thf)<sub>2</sub>Ln(Ge<sub>9</sub>{Si(SiMe<sub>3</sub>)<sub>3</sub>}<sub>3</sub>)<sub>2</sub> (Ln = Eu, Sm): the first coordination of metalloid germanium clusters to lanthanides.","Chemical communications (Cambridge, England)","2021","57","38","4730","4733","10.1039/d1cc01151k","","x-ray","0.71073","MoKα","","0.1029","0.0488","","","0.1037","0.1262","","","","","","1.018","","","","has coordinates,has disorder","265903","2021-06-05","17:33:44",""
"7128124","22.778","0.003","24.085","0.003","29.746","0.004","90","","112.419","0.002","90","","15086","3","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H178 Eu Ge18 O2 Si24 -","- C62 H178 Eu Ge18 O2 Si24 -","- C248 H712 Eu4 Ge72 O8 Si96 -","4","1","","Klementyeva, Svetlana V.; Schrenk, Claudio; Zhang, Minghui; Khusniyarov, Marat M.; Schnepf, Andreas","(thf)<sub>2</sub>Ln(Ge<sub>9</sub>{Si(SiMe<sub>3</sub>)<sub>3</sub>}<sub>3</sub>)<sub>2</sub> (Ln = Eu, Sm): the first coordination of metalloid germanium clusters to lanthanides.","Chemical communications (Cambridge, England)","2021","57","38","4730","4733","10.1039/d1cc01151k","","x-ray","0.71073","MoKα","","0.1435","0.0602","","","0.1345","0.1789","","","","","","1.017","","","","has coordinates","265903","2021-06-05","17:33:45",""
"7128125","21.0176","0.0005","11.6607","0.0003","11.4688","0.0002","90","","90","","90","","2810.77","0.11","150","","150","","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C31 H23 Cl2 N O P2 Pd -","- C31 H23 Cl2 N O P2 Pd -","- C124 H92 Cl8 N4 O4 P8 Pd4 -","4","1","","Kunchur, Harish S.; Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.","Novel approach to benzo-fused 1,2-azaphospholene involving a Pd(II)-assisted tandem P-C bond cleavage and P-N bond formation reaction.","Chemical communications (Cambridge, England)","2021","57","39","4835","4838","10.1039/d1cc01591e","","","0.71073","MoKα","","0.0312","0.0292","","","0.064","0.0657","","","","","","1.042","","","","has coordinates","265874","2021-06-05","17:26:58",""
"7128126","12.7967","0.0004","14.2667","0.0004","14.5382","0.0004","63.884","0.002","64.063","0.003","63.623","0.003","2036.34","0.12","150","","150","","","","","","","","","9","P -1","-P 1","2","","","","- C86 H70 Cl2 F12 N2 O2 P4 Pd2 Sb2 -","- C86 H70 Cl2 F12 N2 O2 P4 Pd2 Sb2 -","- C86 H70 Cl2 F12 N2 O2 P4 Pd2 Sb2 -","1","0.5","","Kunchur, Harish S.; Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.","Novel approach to benzo-fused 1,2-azaphospholene involving a Pd(II)-assisted tandem P-C bond cleavage and P-N bond formation reaction.","Chemical communications (Cambridge, England)","2021","57","39","4835","4838","10.1039/d1cc01591e","","","0.71073","MoKα","","0.0627","0.0555","","","0.1422","0.1494","","","","","","1.079","","","","has coordinates,has disorder","265874","2021-06-05","17:26:58",""
"7128127","10.7527","0.0004","12.1363","0.0005","15.65","0.0006","96.247","0.003","94.277","0.003","106.011","0.003","1939.69","0.14","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C43 H39 Cl2 N O P2 Pd2 -","- C43 H39 Cl2 N O P2 Pd2 -","- C86 H78 Cl4 N2 O2 P4 Pd4 -","2","1","","Kunchur, Harish S.; Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.","Novel approach to benzo-fused 1,2-azaphospholene involving a Pd(II)-assisted tandem P-C bond cleavage and P-N bond formation reaction.","Chemical communications (Cambridge, England)","2021","57","39","4835","4838","10.1039/d1cc01591e","","","0.71073","MoKα","","0.0849","0.0575","","","0.1229","0.1449","","","","","","1.041","","","","has coordinates","265874","2021-06-05","17:26:58",""
"7128128","9.6861","0.0002","10.1225","0.0002","17.843","0.0004","91.809","0.002","95.505","0.002","115.634","0.002","1564.79","0.06","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C37 H28 Cl N O P2 Pd -","- C37 H28 Cl N O P2 Pd -","- C74 H56 Cl2 N2 O2 P4 Pd2 -","2","1","","Kunchur, Harish S.; Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.","Novel approach to benzo-fused 1,2-azaphospholene involving a Pd(II)-assisted tandem P-C bond cleavage and P-N bond formation reaction.","Chemical communications (Cambridge, England)","2021","57","39","4835","4838","10.1039/d1cc01591e","","x-ray","0.71073","MoKα","","0.0408","0.0346","","","0.0765","0.0799","","","","","","1.039","","","","has coordinates","265874","2021-06-05","17:26:58",""
"7128129","14.7277","0.0005","12.293","0.0004","21.1373","0.0007","90","","90","","90","","3826.9","0.2","170","2","170.15","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H19 N3 O3 -","- C24 H19 N3 O3 -","- C192 H152 N24 O24 -","8","1","","Xiao, Xiao; Shao, Bingxuan; Li, Jingyi; Yang, Zehui; Lu, Yin-Jie; Ling, Fei; Zhong, Weihui","Enantioselective synthesis of functionalized 1,4-dihydropyrazolo-[4',3':5,6]pyrano[2,3-<i>b</i>]quinolines through ferrocenyl-phosphine-catalyzed annulation of modified MBH carbonates and pyrazolones.","Chemical communications (Cambridge, England)","2021","57","38","4690","4693","10.1039/d1cc00989c","","","1.54178","CuKα","","0.039","0.038","","","0.0979","0.0988","","","","","","1.082","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128130","11.9239","0.0004","5.6798","0.0002","14.6714","0.0006","90","","110.215","0.004","90","","932.42","0.06","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H21 F O -","- C25 H21 F O -","- C50 H42 F2 O2 -","2","1","","Gillbard, Simone M.; Green, Harley; Argent, Stephen P.; Lam, Hon Wai","Enantioselective nickel-catalyzed <i>anti</i>-arylmetallative cyclizations onto acyclic electron-deficient alkenes.","Chemical communications (Cambridge, England)","2021","57","36","4436","4439","10.1039/d1cc01166a","","x-ray","1.54184","CuKα","","0.0347","0.0328","","","0.082","0.0841","","","","","","1.055","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128131","8.4023","0.0002","11.0606","0.0002","9.9012","0.0002","90","","99.589","0.002","90","","907.31","0.03","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H19 F O S -","- C23 H19 F O S -","- C46 H38 F2 O2 S2 -","2","1","","Gillbard, Simone M.; Green, Harley; Argent, Stephen P.; Lam, Hon Wai","Enantioselective nickel-catalyzed <i>anti</i>-arylmetallative cyclizations onto acyclic electron-deficient alkenes.","Chemical communications (Cambridge, England)","2021","57","36","4436","4439","10.1039/d1cc01166a","","x-ray","1.54184","CuKα","","0.0257","0.0252","","","0.0667","0.0672","","","","","","1.021","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128132","12.2119","0.0001","5.6331","0.0001","14.2712","0.0001","90","","106.598","0.001","90","","940.82","0.02","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H25 F O -","- C23 H25 F O -","- C46 H50 F2 O2 -","2","1","","Gillbard, Simone M.; Green, Harley; Argent, Stephen P.; Lam, Hon Wai","Enantioselective nickel-catalyzed <i>anti</i>-arylmetallative cyclizations onto acyclic electron-deficient alkenes.","Chemical communications (Cambridge, England)","2021","57","36","4436","4439","10.1039/d1cc01166a","","x-ray","1.54184","CuKα","","0.029","0.0287","","","0.0719","0.0722","","","","","","1.05","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128133","7.4283","0.0001","6.9661","0.0001","16.5307","0.0002","90","","93.4","0.001","90","","853.9","0.02","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H18 O S2 -","- C21 H18 O S2 -","- C42 H36 O2 S4 -","2","1","","Gillbard, Simone M.; Green, Harley; Argent, Stephen P.; Lam, Hon Wai","Enantioselective nickel-catalyzed <i>anti</i>-arylmetallative cyclizations onto acyclic electron-deficient alkenes.","Chemical communications (Cambridge, England)","2021","57","36","4436","4439","10.1039/d1cc01166a","","x-ray","1.54184","CuKα","","0.0235","0.0233","","","0.0635","0.0636","","","","","","1.04","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128134","9.4068","0.0005","21.5669","0.0009","9.8567","0.0006","90","","94.988","0.005","90","","1992.11","0.18","293.5","0.1","293.5","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N3 O5 -","- C20 H21 N3 O5 -","- C80 H84 N12 O20 -","4","1","","Sang, Ji-Wei; Xie, Ming-Sheng; Wang, Man-Man; Qu, Gui-Rong; Guo, Hai-Ming","Chemo- and regioselective ring-opening of donor-acceptor oxiranes with <i>N</i>-heteroaromatics.","Chemical communications (Cambridge, England)","2021","57","37","4552","4555","10.1039/d1cc00600b","","x-ray","0.71073","MoKα","","0.094","0.0607","","","0.1341","0.1536","","","","","","1.026","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128135","11.8048","0.0009","15.1785","0.001","16.7524","0.0012","89.985","0.006","87.821","0.006","80.497","0.006","2958.3","0.4","149.99","0.1","149.99","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C19 H19 Cl N4 O5 -","- C19 H19 Cl N4 O5 -","- C114 H114 Cl6 N24 O30 -","6","3","","Sang, Ji-Wei; Xie, Ming-Sheng; Wang, Man-Man; Qu, Gui-Rong; Guo, Hai-Ming","Chemo- and regioselective ring-opening of donor-acceptor oxiranes with <i>N</i>-heteroaromatics.","Chemical communications (Cambridge, England)","2021","57","37","4552","4555","10.1039/d1cc00600b","","x-ray","0.71073","MoKα","","0.0985","0.0752","","","0.1823","0.2015","","","","","","1.051","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128136","14.9392","0.0005","15.2205","0.0004","19.081","0.0005","90","","90","","90","","4338.7","0.2","295.28","0.11","295.28","0.11","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H19 Cl2 N3 O5 -","- C20 H19 Cl2 N3 O5 -","- C160 H152 Cl16 N24 O40 -","8","2","","Sang, Ji-Wei; Xie, Ming-Sheng; Wang, Man-Man; Qu, Gui-Rong; Guo, Hai-Ming","Chemo- and regioselective ring-opening of donor-acceptor oxiranes with <i>N</i>-heteroaromatics.","Chemical communications (Cambridge, England)","2021","57","37","4552","4555","10.1039/d1cc00600b","","x-ray","1.54184","CuKα","","0.0861","0.0769","","","0.2086","0.2268","","","","","","1.029","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128137","9.5126","0.0002","21.7936","0.0004","9.7318","0.0003","90","","95.48","0.002","90","","2008.32","0.08","295.75","0.1","295.75","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 F N3 O5 -","- C20 H20 F N3 O5 -","- C80 H80 F4 N12 O20 -","4","1","","Sang, Ji-Wei; Xie, Ming-Sheng; Wang, Man-Man; Qu, Gui-Rong; Guo, Hai-Ming","Chemo- and regioselective ring-opening of donor-acceptor oxiranes with <i>N</i>-heteroaromatics.","Chemical communications (Cambridge, England)","2021","57","37","4552","4555","10.1039/d1cc00600b","","x-ray","1.54184","CuKα","","0.0662","0.057","","","0.1406","0.1492","","","","","","1.105","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128138","9.5779","0.0005","11.3128","0.0007","11.849","0.0008","61.499","0.007","78.529","0.005","86.047","0.005","1105.24","0.14","290","4","290","4","","","","","","","","4","P -1","-P 1","2","","","","- C22 H25 N3 O5 -","- C22 H25 N3 O5 -","- C44 H50 N6 O10 -","2","1","","Sang, Ji-Wei; Xie, Ming-Sheng; Wang, Man-Man; Qu, Gui-Rong; Guo, Hai-Ming","Chemo- and regioselective ring-opening of donor-acceptor oxiranes with <i>N</i>-heteroaromatics.","Chemical communications (Cambridge, England)","2021","57","37","4552","4555","10.1039/d1cc00600b","","x-ray","1.54184","CuKα","","0.0668","0.0619","","","0.1864","0.1923","","","","","","1.048","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128139","15.756","0.004","14.59","0.003","9.628","0.002","90","","103.67","0.02","90","","2150.6","0.9","149.98","0.1","149.98","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H23 Cl N2 O5 -","- C22 H23 Cl N2 O5 -","- C88 H92 Cl4 N8 O20 -","4","1","","Sang, Ji-Wei; Xie, Ming-Sheng; Wang, Man-Man; Qu, Gui-Rong; Guo, Hai-Ming","Chemo- and regioselective ring-opening of donor-acceptor oxiranes with <i>N</i>-heteroaromatics.","Chemical communications (Cambridge, England)","2021","57","37","4552","4555","10.1039/d1cc00600b","","x-ray","0.71073","MoKα","","0.1496","0.0789","","","0.1861","0.2389","","","","","","1.018","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128140","8.3393","0.0002","21.3081","0.0006","11.1096","0.0004","90","","100.128","0.003","90","","1943.35","0.1","292.8","0.4","292.8","0.4","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H21 N3 O5 -","- C20 H21 N3 O5 -","- C80 H84 N12 O20 -","4","1","","Sang, Ji-Wei; Xie, Ming-Sheng; Wang, Man-Man; Qu, Gui-Rong; Guo, Hai-Ming","Chemo- and regioselective ring-opening of donor-acceptor oxiranes with <i>N</i>-heteroaromatics.","Chemical communications (Cambridge, England)","2021","57","37","4552","4555","10.1039/d1cc00600b","","x-ray","1.54184","CuKα","","0.0661","0.0557","","","0.133","0.1388","","","","","","1.055","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128141","19.544","0.004","18.626","0.004","26.122","0.005","90","","90","","90","","9509","3","293","2","293","2","","","","","","","","7","P 2 2 21","P 2c 2","17","","","","- C150 H204 Au17 B Cd2 P4 S12 -","- C150 H198 Au17 B Cd2 P4 S12 -","- C300 H396 Au34 B2 Cd4 P8 S24 -","2","0.5","","Li, Tianrong; Li, Qinzhen; Yang, Sha; Xu, Liyun; Chai, Jinsong; Li, Peng; Zhu, Manzhou","Surface engineering of linearly fused Au<sub>13</sub> units using diphosphine and Cd doping.","Chemical communications (Cambridge, England)","2021","57","38","4682","4685","10.1039/d1cc00577d","","","0.71073","MoKα","","0.0948","0.0734","","","0.1965","0.2182","","","","","","0.968","","","","has coordinates,has disorder","265902","2021-06-05","17:33:27",""
"7128142","27.2386","0.0012","44.912","0.0015","25.7433","0.0013","90","","90","","90","","31493","2","293","2","293","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C238 H277 Au29 Cd2 Fe2 P4 S17 -","- C238 H277 Au29 Cd2 Fe2 P4 S17 -","- C952 H1108 Au116 Cd8 Fe8 P16 S68 -","4","0.5","","Li, Tianrong; Li, Qinzhen; Yang, Sha; Xu, Liyun; Chai, Jinsong; Li, Peng; Zhu, Manzhou","Surface engineering of linearly fused Au<sub>13</sub> units using diphosphine and Cd doping.","Chemical communications (Cambridge, England)","2021","57","38","4682","4685","10.1039/d1cc00577d","","","1.54186","CuKα","","0.0746","0.0582","","","0.1431","0.15","","","","","","1.051","","","","has coordinates,has disorder","265902","2021-06-05","17:33:27",""
"7128143","8.5243","0.0002","14.7793","0.0004","15.8032","0.0004","90","","90","","90","","1990.94","0.09","145","2","145","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H21 F O5 -","- C23 H21 F O5 -","- C92 H84 F4 O20 -","4","1","","Lu, Mengxue; Xiong, Zongli; Zhou, Yuqiao; Wang, Xin; Li, Xiaoyi; Duan, Jingxiang; Yao, Weijun; Xia, Yi; Wang, Zhen","Assembly of fluorinated chromanones <i>via</i> enantioselective tandem reaction.","Chemical communications (Cambridge, England)","2021","57","38","4722","4725","10.1039/d1cc01187a","","","1.54178","CuKα","","0.0354","0.0331","","","0.0843","0.0874","","","","","","1.089","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128144","15.0201","0.0006","9.3245","0.0004","25.3352","0.0011","90","","104.918","0.001","90","","3428.7","0.3","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H15 F4 O P -","- C20 H15 F4 O P -","- C160 H120 F32 O8 P8 -","8","2","","Smirnov, Vladimir O.; Volodin, Alexander D.; Korlyukov, Alexander A.; Dilman, Alexander D.","All-carbon phosphoranes <i>via</i> difluorocarbene trapping.","Chemical communications (Cambridge, England)","2021","57","39","4823","4826","10.1039/d1cc01075a","","x-ray","0.71073","MoKα","","0.095","0.0552","","","0.1084","0.1216","","","","","","1.099","","","","has coordinates,has disorder","265877","2021-06-05","17:27:25",""
"7128145","10.1354","0.0006","12.5827","0.0008","14.7085","0.0009","89.257","0.002","74.417","0.002","75.991","0.002","1750.37","0.19","296.15","","296.15","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H15 F2 O2 P -","- C20 H15 F2 O2 P -","- C80 H60 F8 O8 P4 -","4","2","","Smirnov, Vladimir O.; Volodin, Alexander D.; Korlyukov, Alexander A.; Dilman, Alexander D.","All-carbon phosphoranes <i>via</i> difluorocarbene trapping.","Chemical communications (Cambridge, England)","2021","57","39","4823","4826","10.1039/d1cc01075a","","","0.71073","MoKα","","0.0672","0.0511","","","0.1332","0.1483","","","","","","1.013","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128146","9.0837","0.001","22.765","0.002","9.4866","0.0011","90","","117.427","0.003","90","","1741.2","0.3","120","","120","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H15 F4 P S -","- C20 H15 F4 P S -","- C80 H60 F16 P4 S4 -","4","1","","Smirnov, Vladimir O.; Volodin, Alexander D.; Korlyukov, Alexander A.; Dilman, Alexander D.","All-carbon phosphoranes <i>via</i> difluorocarbene trapping.","Chemical communications (Cambridge, England)","2021","57","39","4823","4826","10.1039/d1cc01075a","","","0.71073","MoKα","","0.0795","0.0491","","","0.1043","0.1154","","","","","","1.033","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128147","6.6884","0.001","13.82","0.002","8.53","0.0013","90","","92.21","0.002","90","","787.9","0.2","273","2","273.15","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H16 Br N O4 -","- C15 H16 Br N O4 -","- C30 H32 Br2 N2 O8 -","2","1","","Huang, Jian; Kong, Han-Han; Li, Si-Jia; Zhang, Rui-Jin; Qian, Hao-Dong; Li, Dan-Ran; He, Jin-Yu; Zheng, Yi-Nuo; Xu, Hao","Asymmetric copper-catalyzed propargylic amination with amine hydrochloride salts.","Chemical communications (Cambridge, England)","2021","57","38","4674","4677","10.1039/d1cc00663k","","","1.34139","GaKα","","0.0639","0.0638","","","0.1662","0.1663","","","","","","1.202","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128148","43.7163","0.0005","43.7163","0.0005","43.7163","0.0005","90","","90","","90","","83546.9","1.7","175","2","175","2","","","","","","","","6","P n -3 n :2","-P 4a 2bc 3","222","","","","- C24 H96 Cu6 N24 Nb68 O204 -","- C24 H96 Cu6 N24 Nb68 O204 -","- C192 H768 Cu48 N192 Nb544 O1632 -","8","0.166667","","Lin, Yu-Diao; Zhu, Zeng-Kui; Ge, Rui; Yu, Hao; Li, Zhong; Sun, Cai; Sun, Yan-Qiong; Li, Xin-Xiong; Zheng, Shou-Tian","Proton conductive polyoxoniobate frameworks constructed from nanoscale {Nb<sub>68</sub>O<sub>200</sub>} cages.","Chemical communications (Cambridge, England)","2021","57","38","4702","4705","10.1039/d1cc00388g","","","0.71073","MoKα","","0.0959","0.0721","","","0.1601","0.1719","","","","","","1.059","","","","has coordinates","265904","2021-06-05","17:34:02",""
"7128149","39.726","0.003","29.335","0.002","20.427","0.0014","90","","90.69","0.002","90","","23803","3","175","2","175","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C40 H160 Cu10 N40 Nb68 O208 -","- C40 H160 Cu10 N40 Nb68 O208 -","- C80 H320 Cu20 N80 Nb136 O416 -","2","0.25","","Lin, Yu-Diao; Zhu, Zeng-Kui; Ge, Rui; Yu, Hao; Li, Zhong; Sun, Cai; Sun, Yan-Qiong; Li, Xin-Xiong; Zheng, Shou-Tian","Proton conductive polyoxoniobate frameworks constructed from nanoscale {Nb<sub>68</sub>O<sub>200</sub>} cages.","Chemical communications (Cambridge, England)","2021","57","38","4702","4705","10.1039/d1cc00388g","","","0.71073","MoKα","","0.0758","0.0596","","","0.1695","0.1778","","","","","","1.003","","","","has coordinates","265904","2021-06-05","17:34:03",""
"7128150","9.2183","0.0006","9.6315","0.0006","11.5543","0.0008","67.512","0.002","88.551","0.002","89.108","0.002","947.53","0.11","100","2","100","","","","","","","","","4","P -1","-P 1","2","","","","- C10 H24 Cl7 N -","- C10 H24 Cl7 N -","- C20 H48 Cl14 N2 -","2","1","","Pröhm, Patrick; Schwarze, Nico; Müller, Carsten; Steinhauer, Simon; Beckers, Helmut; Rupf, Susanne M.; Riedel, Sebastian","Non-classical polyinterhalides of chlorine monofluoride: experimental and theoretical characterization of [F(ClF)<sub>3</sub>]<sup/>.","Chemical communications (Cambridge, England)","2021","57","39","4843","4846","10.1039/d1cc01088c","","","0.71073","MoKα","","0.0325","0.0301","","","0.0763","0.0778","","","","","","1.132","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128151","11.8381","0.0002","10.0385","0.0002","9.3211","0.0002","90","","90","","90","","1107.69","0.04","100","","100","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C4 H12 Cl3 F4 N -","- C4 H12 Cl3 F4 N -","- C16 H48 Cl12 F16 N4 -","4","1","","Pröhm, Patrick; Schwarze, Nico; Müller, Carsten; Steinhauer, Simon; Beckers, Helmut; Rupf, Susanne M.; Riedel, Sebastian","Non-classical polyinterhalides of chlorine monofluoride: experimental and theoretical characterization of [F(ClF)<sub>3</sub>]<sup/>.","Chemical communications (Cambridge, England)","2021","57","39","4843","4846","10.1039/d1cc01088c","","","1.54178","CuKα","","0.0204","0.0199","","","0.0517","0.0523","","","","","","1.069","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128152","11.6354","0.0009","11.6529","0.0009","11.9411","0.0009","87.746","0.002","83.905","0.001","89.123","0.001","1608.5","0.2","100","2","100","","","","","","","","","7","P -1","-P 1","2","","[Zn(hydrotris(5,3-Methylphenylpyrazolyl)borate)(5-fluoropicolinic acid)]","","- C36 H31 B F N7 O2 Zn -","- C36 H31 B F N7 O2 Zn -","- C72 H62 B2 F2 N14 O4 Zn2 -","2","1","","Prosser, Kathleen E.; Kohlbrand, Alysia J.; Seo, Hyeonglim; Kalaj, Mark; Cohen, Seth M.","<sup>19</sup>F-Tagged metal binding pharmacophores for NMR screening of metalloenzymes.","Chemical communications (Cambridge, England)","2021","57","40","4934","4937","10.1039/d1cc01231b","","","0.71073","MoKα","","0.0477","0.0354","","","0.0777","0.083","","","","","","1.042","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128153","12.5509","0.0014","12.1199","0.0012","23.821","0.003","90","","96.616","0.004","90","","3599.4","0.7","273.15","","273.15","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 B N7 O2 S Zn -","- C40 H38 B N7 O2 S Zn -","- C160 H152 B4 N28 O8 S4 Zn4 -","4","1","","Prosser, Kathleen E.; Kohlbrand, Alysia J.; Seo, Hyeonglim; Kalaj, Mark; Cohen, Seth M.","<sup>19</sup>F-Tagged metal binding pharmacophores for NMR screening of metalloenzymes.","Chemical communications (Cambridge, England)","2021","57","40","4934","4937","10.1039/d1cc01231b","","","0.71073","MoKα","","0.0866","0.0707","","","0.1548","0.163","","","","","","1.129","","","","has coordinates","265882","2021-06-05","17:28:28",""
"7128154","33.345","0.004","33.345","0.004","17.251","0.003","90","","90","","120","","16611","4","100","","100","","","","","","","","","8","R -3 :H","-R 3","148","","","","- C37 H33 B F3 N7 O2 S Zn -","- C37 H33 B F3 N7 O2 S Zn -","- C666 H594 B18 F54 N126 O36 S18 Zn18 -","18","1","","Prosser, Kathleen E.; Kohlbrand, Alysia J.; Seo, Hyeonglim; Kalaj, Mark; Cohen, Seth M.","<sup>19</sup>F-Tagged metal binding pharmacophores for NMR screening of metalloenzymes.","Chemical communications (Cambridge, England)","2021","57","40","4934","4937","10.1039/d1cc01231b","","","0.71073","MoKα","","0.0585","0.0392","","","0.0906","0.0995","","","","","","1.03","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128155","12.6333","0.0012","5.571","0.0005","20.8717","0.0018","90","","101.874","0.003","90","","1437.5","0.2","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 N O2 -","- C18 H15 N O2 -","- C72 H60 N4 O8 -","4","1","","Hu, Yan; Nan, Jiang; Gong, Xue; Zhang, Jiawen; Yin, Jiacheng; Ma, Yangmin","Zinc-catalyzed C-H alkenylation of quinoline <i>N</i>-oxides with ynones: a new strategy towards quinoline-enol scaffolds.","Chemical communications (Cambridge, England)","2021","57","40","4930","4933","10.1039/d1cc00245g","","","0.71073","MoKα","","0.1368","0.0649","","","0.1637","0.2311","","","","","","1.03","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128156","12.837","0.0003","13.5455","0.0002","19.9735","0.0003","77.7928","0.0013","73.9712","0.0016","70.0209","0.0017","3110.67","0.11","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C72 H64 N12 O2 -","- C72 H64 N12 O2 -","- C144 H128 N24 O4 -","2","1","","Li, Aimin; Xiong, Shenglun; Zhou, Wei; Zhai, Huijuan; Liu, Yuanchu; He, Qing","Superphane: a new lantern-like receptor for encapsulation of a water dimer.","Chemical communications (Cambridge, England)","2021","57","37","4496","4499","10.1039/d1cc01158h","","","1.54184","CuKα","","0.108","0.0888","","","0.2194","0.2336","","","","","","1.042","","","","has coordinates,has disorder","265845","2021-06-05","17:18:22",""
"7128157","11.6468","0.0005","12.4428","0.0006","14.4199","0.0007","105.247","0.004","94.682","0.004","92.488","0.004","2004.85","0.17","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","N,N'-Bis(4-(2,2-dimethylethyl)phenyl)sulfamide","","- C20 H28 N2 O2 S -","- C20 H28 N2 O2 S -","- C80 H112 N8 O8 S4 -","4","2","","Blum, Stephan P.; Schäffer, Lukas; Schollmeyer, Dieter; Waldvogel, Siegfried R.","Electrochemical synthesis of sulfamides.","Chemical communications (Cambridge, England)","2021","57","39","4775","4778","10.1039/d1cc01428e","","","0.71073","MoKα","","0.0663","0.0507","","","0.1169","0.1279","","","","","","1.056","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128158","10.468","0.0004","11.2779","0.0004","13.2284","0.0005","66.285","0.001","69.186","0.001","78.163","0.001","1332.98","0.09","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H33 P S -","- C34 H33 P S -","- C68 H66 P2 S2 -","2","1","","Yang, Wenbang; Wang, Wenqing; Zhang, Leran; Zhang, Li; Ruan, Huapeng; Feng, Zhongtao; Fang, Yong; Wang, Xinping","Persistent 2<i>c</i>-3<i>e</i> σ-bonded heteronuclear radical cations centered on S/Se and P/As atoms.","Chemical communications (Cambridge, England)","2021","57","41","5067","5070","10.1039/d1cc01117k","","","0.71073","MoKα","","0.0433","0.0383","","","0.0974","0.1017","","","","","","1.045","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128159","10.457","0.0006","11.3972","0.0007","13.2662","0.0008","66.746","0.002","68.994","0.001","78.78","0.002","1353.5","0.14","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H33 As S -","- C34 H33 As S -","- C68 H66 As2 S2 -","2","1","","Yang, Wenbang; Wang, Wenqing; Zhang, Leran; Zhang, Li; Ruan, Huapeng; Feng, Zhongtao; Fang, Yong; Wang, Xinping","Persistent 2<i>c</i>-3<i>e</i> σ-bonded heteronuclear radical cations centered on S/Se and P/As atoms.","Chemical communications (Cambridge, England)","2021","57","41","5067","5070","10.1039/d1cc01117k","","","0.71073","MoKα","","0.0256","0.0234","","","0.0618","0.063","","","","","","1.059","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128160","10.4597","0.0005","11.332","0.0005","13.2801","0.0006","66.289","0.001","69.731","0.001","78.792","0.001","1349.18","0.11","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H33 P Se -","- C34 H33 P Se -","- C68 H66 P2 Se2 -","2","1","","Yang, Wenbang; Wang, Wenqing; Zhang, Leran; Zhang, Li; Ruan, Huapeng; Feng, Zhongtao; Fang, Yong; Wang, Xinping","Persistent 2<i>c</i>-3<i>e</i> σ-bonded heteronuclear radical cations centered on S/Se and P/As atoms.","Chemical communications (Cambridge, England)","2021","57","41","5067","5070","10.1039/d1cc01117k","","","1.34139","GaKα","","0.0332","0.032","","","0.0824","0.084","","","","","","1.038","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128161","10.4307","0.0004","11.4296","0.0004","13.3226","0.0004","66.958","0.001","69.688","0.001","79.648","0.001","1368.93","0.08","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H33 As Se -","- C34 H33 As Se -","- C68 H66 As2 Se2 -","2","1","","Yang, Wenbang; Wang, Wenqing; Zhang, Leran; Zhang, Li; Ruan, Huapeng; Feng, Zhongtao; Fang, Yong; Wang, Xinping","Persistent 2<i>c</i>-3<i>e</i> σ-bonded heteronuclear radical cations centered on S/Se and P/As atoms.","Chemical communications (Cambridge, England)","2021","57","41","5067","5070","10.1039/d1cc01117k","","","1.34139","GaKα","","0.0274","0.0258","","","0.07","0.0713","","","","","","1.041","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128162","3.8373","0.001","20.9685","0.001","9.8459","0.001","90","","94.765","0.01","90","","789.5","0.2","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H6 N O2 -","- C9 H6 N O2 -","- C36 H24 N4 O8 -","4","1","","Tse, Yuen Cheong; Docker, Andrew; Zhang, Zongyao; Beer, Paul D.","Lithium halide ion-pair recognition with halogen bonding and chalcogen bonding heteroditopic macrocycles.","Chemical communications (Cambridge, England)","2021","57","40","4950","4953","10.1039/d1cc01287h","","","1.5418","CuKα","","0.0459","0.0405","","0.0755","0.0558","0.0558","","","","","","1.0175","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128163","25.3739","0.0002","27.4143","0.0002","14.3651","0.0001","90","","105.199","0.001","90","","9642.95","0.13","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H42 I2 N8 O6.2 -","- C45 H42 I2 N8 O6.2 -","- C360 H336 I16 N64 O49.6 -","8","1","","Tse, Yuen Cheong; Docker, Andrew; Zhang, Zongyao; Beer, Paul D.","Lithium halide ion-pair recognition with halogen bonding and chalcogen bonding heteroditopic macrocycles.","Chemical communications (Cambridge, England)","2021","57","40","4950","4953","10.1039/d1cc01287h","","","1.54178","CuKα","","0.083","0.081","","","0.2274","0.2347","","","","","","1.099","","","","has coordinates","265887","2021-06-05","17:29:30",""
"7128164","16.904","0.003","22.714","0.005","29.166","0.006","78.57","0.03","73.36","0.03","69.54","0.03","9993","4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C189 H129 F48 Fe4 N27 O3 P8 -","- C181.5 H111.5 F36 Fe4 N24.5 O0.5 P6 -","- C363 H223 F72 Fe8 N49 O P12 -","2","1","","Siddique, Rashid G.; Arachchige, Kasun S. A.; Al-Fayaad, Hydar A; Brock, Aidan J.; Micallef, Aaron S.; Luis, Ena T.; Thoburn, John D.; McMurtrie, John C.; Clegg, Jack K.","The kinetics and mechanism of interconversion within a system of [Fe<sub>2</sub>L<sub>3</sub>]<sup>4+</sup> helicates and [Fe<sub>4</sub>L<sub>6</sub>]<sup>8+</sup> cages.","Chemical communications (Cambridge, England)","2021","57","40","4918","4921","10.1039/d1cc01583d","","","0.7108","Synchrotron","","0.0768","0.0662","","","0.1963","0.2084","","","","","","1.04","","","","has coordinates,has disorder","265883","2021-06-05","17:28:51",""
"7128165","21.2196","0.0008","21.2196","0.0008","30.9753","0.0011","90","","90","","120","","12078.7","0.8","100","0.3","100","0.3","","","","","","","","7","P -3","-P 3","147","","","","- C219 H238.5 F48 Fe4 N37.5 O9 P8 -","- C177 H148.5 F42 Fe4 N25.5 O4.5 P7 -","- C354 H297 F84 Fe8 N51 O9 P14 -","2","0.333333","","Siddique, Rashid G.; Arachchige, Kasun S. A.; Al-Fayaad, Hydar A; Brock, Aidan J.; Micallef, Aaron S.; Luis, Ena T.; Thoburn, John D.; McMurtrie, John C.; Clegg, Jack K.","The kinetics and mechanism of interconversion within a system of [Fe<sub>2</sub>L<sub>3</sub>]<sup>4+</sup> helicates and [Fe<sub>4</sub>L<sub>6</sub>]<sup>8+</sup> cages.","Chemical communications (Cambridge, England)","2021","57","40","4918","4921","10.1039/d1cc01583d","","x-ray","0.71073","MoKα","","0.1642","0.13","","","0.3195","0.3394","","","","","","1.08","","","","has coordinates,has disorder","265883","2021-06-05","17:28:52",""
"7128166","11.112","0.002","12.5","0.003","15.599","0.003","90","","90","","90","","2166.7","0.8","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C30 H18 N4 -","- C30 H18 N4 -","- C120 H72 N16 -","4","0.5","","Siddique, Rashid G.; Arachchige, Kasun S. A.; Al-Fayaad, Hydar A; Brock, Aidan J.; Micallef, Aaron S.; Luis, Ena T.; Thoburn, John D.; McMurtrie, John C.; Clegg, Jack K.","The kinetics and mechanism of interconversion within a system of [Fe<sub>2</sub>L<sub>3</sub>]<sup>4+</sup> helicates and [Fe<sub>4</sub>L<sub>6</sub>]<sup>8+</sup> cages.","Chemical communications (Cambridge, England)","2021","57","40","4918","4921","10.1039/d1cc01583d","","","0.7108","Synchrotron","","0.0562","0.0467","","","0.1232","0.1302","","","","","","1.078","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128167","13.4333","0.0013","13.4333","0.0013","27.74","0.006","90","","90","","120","","4335.1","1.1","100","2","100","2","","","","","","","","6","P 63 2 2","P 6c 2c","182","","","","- C90 H54 F24 Fe2 N12 P4 -","- C90 H54 Fe2 N12 -","- C180 H108 Fe4 N24 -","2","0.166667","","Siddique, Rashid G.; Arachchige, Kasun S. A.; Al-Fayaad, Hydar A; Brock, Aidan J.; Micallef, Aaron S.; Luis, Ena T.; Thoburn, John D.; McMurtrie, John C.; Clegg, Jack K.","The kinetics and mechanism of interconversion within a system of [Fe<sub>2</sub>L<sub>3</sub>]<sup>4+</sup> helicates and [Fe<sub>4</sub>L<sub>6</sub>]<sup>8+</sup> cages.","Chemical communications (Cambridge, England)","2021","57","40","4918","4921","10.1039/d1cc01583d","","","0.7108","synchrotron","","0.0587","0.0552","","","0.1847","0.188","","","","","","1.181","","","","has coordinates","265883","2021-06-05","17:28:52",""
"7128168","10.673","0.002","10.211","0.002","15.278","0.003","90","","110.38","0.03","90","","1560.8","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 B2 O4 Si2 -","- C28 H44 B2 O4 Si2 -","- C56 H88 B4 O8 Si4 -","2","0.5","","Siddique, Rashid G.; Arachchige, Kasun S. A.; Al-Fayaad, Hydar A; Brock, Aidan J.; Micallef, Aaron S.; Luis, Ena T.; Thoburn, John D.; McMurtrie, John C.; Clegg, Jack K.","The kinetics and mechanism of interconversion within a system of [Fe<sub>2</sub>L<sub>3</sub>]<sup>4+</sup> helicates and [Fe<sub>4</sub>L<sub>6</sub>]<sup>8+</sup> cages.","Chemical communications (Cambridge, England)","2021","57","40","4918","4921","10.1039/d1cc01583d","","","0.7108","synchrotron","","0.0845","0.0606","","","0.1652","0.186","","","","","","1.146","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128169","7.356","0.0015","15.326","0.003","14.709","0.003","90","","99.74","0.03","90","","1634.4","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 N4 Si2 -","- C36 H34 N4 Si2 -","- C72 H68 N8 Si4 -","2","0.5","","Siddique, Rashid G.; Arachchige, Kasun S. A.; Al-Fayaad, Hydar A; Brock, Aidan J.; Micallef, Aaron S.; Luis, Ena T.; Thoburn, John D.; McMurtrie, John C.; Clegg, Jack K.","The kinetics and mechanism of interconversion within a system of [Fe<sub>2</sub>L<sub>3</sub>]<sup>4+</sup> helicates and [Fe<sub>4</sub>L<sub>6</sub>]<sup>8+</sup> cages.","Chemical communications (Cambridge, England)","2021","57","40","4918","4921","10.1039/d1cc01583d","","","0.7108","synchrotron","","0.0555","0.0506","","","0.1409","0.1461","","","","","","1.063","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128170","9.5547","0.0002","10.0105","0.0003","24.6215","0.0005","90","","90","","90","","2354.98","0.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H22 Br N O2 -","- C27 H22 Br N O2 -","- C108 H88 Br4 N4 O8 -","4","1","","Yuan, Shu-Pei; Zhang, Xia-Yan; Jia, Yun-Qing; Wang, Zhen-Hua; Zhao, Jian-Qiang; You, Yong; Zhou, Ming-Qiang; Yuan, Wei-Cheng","Catalytic asymmetric coupling of vinylogous species <i>via</i> deconjugated butenolide addition to vinylogous imines <i>in situ</i> generated from arylsulfonyl indoles.","Chemical communications (Cambridge, England)","2021","57","40","4938","4941","10.1039/d1cc00777g","","","1.54184","CuKα","","0.0554","0.0431","","","0.0954","0.1053","","","","","","1.035","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128171","10.2533","0.001","10.7469","0.001","11.736","0.0009","93.016","0.007","99.314","0.007","116.142","0.01","1134.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H23 N O4 -","- C27 H23 N O4 -","- C54 H46 N2 O8 -","2","1","","Yuan, Shu-Pei; Zhang, Xia-Yan; Jia, Yun-Qing; Wang, Zhen-Hua; Zhao, Jian-Qiang; You, Yong; Zhou, Ming-Qiang; Yuan, Wei-Cheng","Catalytic asymmetric coupling of vinylogous species <i>via</i> deconjugated butenolide addition to vinylogous imines <i>in situ</i> generated from arylsulfonyl indoles.","Chemical communications (Cambridge, England)","2021","57","40","4938","4941","10.1039/d1cc00777g","","x-ray","1.54184","CuKα","","0.0874","0.0525","","","0.1223","0.1505","","","","","","1.044","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128172","11.9988","0.0003","19.1984","0.0005","7.6672","0.0002","90","","106.467","0.002","90","","1693.76","0.08","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","ethyl 10-phenylacenaphtho[1,2-c]pyridine-7-carboxylate","","- C24 H17 N O2 -","- C24 H17 N O2 -","- C96 H68 N4 O8 -","4","1","","Dong, Penghui; Majeed, Kashif; Wang, Lingna; Guo, Zijian; Zhou, Fengtao; Zhang, Qiuyu","Transition metal-free approach to azafluoranthene scaffolds by aldol condensation/[1+2+3] annulation tandem reaction of isocyanoacetates with 8-(alkynyl)-1-naphthaldehydes.","Chemical communications (Cambridge, England)","2021","57","39","4855","4858","10.1039/d1cc01015h","","","1.54178","CuKα","","0.0586","0.0403","","","0.1056","0.1241","","","","","","1.095","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128173","17.9842","0.0007","18.0922","0.0007","15.4453","0.0006","90","","90","","90","","5025.5","0.3","100","2","100","2","","","","","","","","8","I b a 2","I 2 -2c","45","","","","- C44 H33 Cl2 F3 Fe2 O9 P2 S2 -","- C44 H33 Cl2 F3 Fe2 O9 P2 S2 -","- C176 H132 Cl8 F12 Fe8 O36 P8 S8 -","4","0.5","","Zhang, Fanjun; Woods, Toby J.; Rauchfuss, Thomas B.; Arrigoni, Federica; Zampella, Giuseppe","CO substitution by PPh<sub>3</sub> in Fe<sub>2</sub>S<sub>2</sub>(CO)<sub>6</sub> proceeds via a novel Fe<sub>2</sub>S intermediate.","Chemical communications (Cambridge, England)","2021","57","41","5079","5081","10.1039/d1cc00956g","","","0.71073","MoKα","","0.039","0.0387","","","0.1095","0.1098","","","","","","1.103","","","","has coordinates,has disorder","265849","2021-06-05","17:19:14",""
"7128174","19.9398","0.0005","10.634","0.0002","20.6693","0.0005","90","","108.761","0.0008","90","","4149.86","0.17","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H38 Fe2 O7 P2 S -","- C46 H38 Fe2 O7 P2 S -","- C184 H152 Fe8 O28 P8 S4 -","4","1","","Zhang, Fanjun; Woods, Toby J.; Rauchfuss, Thomas B.; Arrigoni, Federica; Zampella, Giuseppe","CO substitution by PPh<sub>3</sub> in Fe<sub>2</sub>S<sub>2</sub>(CO)<sub>6</sub> proceeds via a novel Fe<sub>2</sub>S intermediate.","Chemical communications (Cambridge, England)","2021","57","41","5079","5081","10.1039/d1cc00956g","","","0.71073","MoKα","","0.0687","0.0567","","","0.146","0.1537","","","","","","1.078","","","","has coordinates,has disorder","265849","2021-06-05","17:19:16",""
"7128175","10.9358","0.0004","11.7041","0.0004","18.2029","0.0006","92.9457","0.0005","101.992","0.0005","107.132","0.0006","2162.02","0.13","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H33 F3 Fe2 O9 P2 S2 -","- C44 H33 F3 Fe2 O9 P2 S2 -","- C88 H66 F6 Fe4 O18 P4 S4 -","2","1","","Zhang, Fanjun; Woods, Toby J.; Rauchfuss, Thomas B.; Arrigoni, Federica; Zampella, Giuseppe","CO substitution by PPh<sub>3</sub> in Fe<sub>2</sub>S<sub>2</sub>(CO)<sub>6</sub> proceeds via a novel Fe<sub>2</sub>S intermediate.","Chemical communications (Cambridge, England)","2021","57","41","5079","5081","10.1039/d1cc00956g","","","0.71073","MoKα","","0.0226","0.0214","","","0.0542","0.0551","","","","","","1.052","","","","has coordinates","265849","2021-06-05","17:19:16",""
"7128176","12.091","0.0002","5.3579","0.0001","12.424","0.0001","90","","101.87","0.001","90","","787.65","0.02","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H5 Cl2 I -","- C6 H5 Cl2 I -","- C24 H20 Cl8 I4 -","4","1","","Poynder, Tiffany B.; Chamorro Orué, Analia I; Tania, ?; Sharp-Bucknall, Lachlan; Flynn, Matthew T.; Wilson, David J. D.; Athukorala Arachchige, Kasun S.; Clegg, Jack K.; Dutton, Jason L.","On the activation of PhICl<sub>2</sub> with pyridine.","Chemical communications (Cambridge, England)","2021","57","40","4970","4973","10.1039/d1cc01567b","","x-ray","0.56087","AgKα","","0.0208","0.0162","","","0.0392","0.0402","","","","","","1.05","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128177","8.9394","0.0003","15.5397","0.0004","9.5747","0.0003","90","","107.339","0.004","90","","1269.63","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 Cl2 I N -","- C11 H10 Cl2 I N -","- C44 H40 Cl8 I4 N4 -","4","1","","Poynder, Tiffany B.; Chamorro Orué, Analia I; Tania, ?; Sharp-Bucknall, Lachlan; Flynn, Matthew T.; Wilson, David J. D.; Athukorala Arachchige, Kasun S.; Clegg, Jack K.; Dutton, Jason L.","On the activation of PhICl<sub>2</sub> with pyridine.","Chemical communications (Cambridge, England)","2021","57","40","4970","4973","10.1039/d1cc01567b","","","0.71073","MoKα","","0.0358","0.0338","","","0.0773","0.0786","","","","","","1.055","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128178","7.7784","0.0002","9.3743","0.0002","16.8499","0.0005","90","","95.923","0.003","90","","1222.09","0.06","149.99","0.1","149.99","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C8 H10 Cl F3 N2 O3 S -","- C8 H10 Cl F3 N2 O3 S -","- C32 H40 Cl4 F12 N8 O12 S4 -","4","1","","Poynder, Tiffany B.; Chamorro Orué, Analia I; Tania, ?; Sharp-Bucknall, Lachlan; Flynn, Matthew T.; Wilson, David J. D.; Athukorala Arachchige, Kasun S.; Clegg, Jack K.; Dutton, Jason L.","On the activation of PhICl<sub>2</sub> with pyridine.","Chemical communications (Cambridge, England)","2021","57","40","4970","4973","10.1039/d1cc01567b","","x-ray","1.54184","CuKα","","0.0857","0.0788","","","0.2045","0.2133","","","","","","1.063","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128179","12.091","0.0002","5.3579","","12.424","","90","","101.87","","90","","787.646","0.013","100","2","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H5 Cl2 I -","- C6 H5 Cl2 I -","- C24 H20 Cl8 I4 -","4","1","","Poynder, Tiffany B.; Chamorro Orué, Analia I; Tania, ?; Sharp-Bucknall, Lachlan; Flynn, Matthew T.; Wilson, David J. D.; Athukorala Arachchige, Kasun S.; Clegg, Jack K.; Dutton, Jason L.","On the activation of PhICl<sub>2</sub> with pyridine.","Chemical communications (Cambridge, England)","2021","57","40","4970","4973","10.1039/d1cc01567b","","","0.56086","AgKα","","0.013","0.013","","","0.0267","0.0267","","","","","","1.008","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128180","13.1045","0.0003","14.6076","0.0004","14.491","0.0004","90","","103.333","0.001","90","","2699.18","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H28 Br N O7 -","- C29 H28 Br N O7 -","- C116 H112 Br4 N4 O28 -","4","1","","Niu, Ben; Wei, Yin; Shi, Min","Palladium catalyzed divergent cycloadditions of vinylidenecyclopropane-diesters with methyleneindolinones enabled by zwitterionic π-propargyl palladium species.","Chemical communications (Cambridge, England)","2021","57","39","4783","4786","10.1039/d1cc01453f","","","0.71073","MoKα","","0.0559","0.0382","","","0.0868","0.0976","","","","","","1.014","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128181","9.492","0.0005","11.5335","0.0006","26.1458","0.0016","90","","97.433","0.002","90","","2838.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H28 Br N O7 -","- C29 H28 Br N O7 -","- C116 H112 Br4 N4 O28 -","4","1","","Niu, Ben; Wei, Yin; Shi, Min","Palladium catalyzed divergent cycloadditions of vinylidenecyclopropane-diesters with methyleneindolinones enabled by zwitterionic π-propargyl palladium species.","Chemical communications (Cambridge, England)","2021","57","39","4783","4786","10.1039/d1cc01453f","","","0.71073","MoKα","","0.1013","0.0532","","","0.127","0.1583","","","","","","1.007","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128182","7.0612","0.0003","10.729","0.0004","16.08","0.0006","88.15","0.002","87.486","0.002","84.532","0.002","1211.02","0.08","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H19 Cl3 N2 O3 -","- C26 H19 Cl3 N2 O3 -","- C52 H38 Cl6 N4 O6 -","2","1","","Chen, Xia; Zhong, Cheng; Lu, Yuling; Yao, Meng; Guan, Zhenhua; Chen, Chunmei; Zhu, Hucheng; Luo, Zengwei; Zhang, Yonghui","Practical access to fluorescent 2,3-naphthalimide derivatives via didehydro-Diels-Alder reaction.","Chemical communications (Cambridge, England)","2021","57","42","5155","5158","10.1039/d1cc01437d","","","1.54178","CuKα","","0.0623","0.058","","","0.1612","0.167","","","","","","1.039","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128183","12.5476","0.0003","18.3022","0.0004","20.615","0.0005","83.0761","0.0013","77.4361","0.0013","79.336","0.0012","4525.1","0.19","100","2","100","","","","","","","","","8","P -1","-P 1","2","","Thiophosphonium salt","","- C88 H88 B Cl4 F24 N6 P S -","- C88 H88 B Cl4 F24 N6 P S -","- C176 H176 B2 Cl8 F48 N12 P2 S2 -","2","1","","Löwe, Pawel; Witteler, Tim; Dielmann, Fabian","Lewis base-free thiophosphonium ion: a cationic sulfur atom transfer reagent.","Chemical communications (Cambridge, England)","2021","57","41","5043","5046","10.1039/d1cc01273h","","","0.71073","MoKα","","0.0528","0.045","","","0.1178","0.1239","","","","","","1.005","","","","has coordinates","265850","2021-06-05","17:19:31",""
"7128184","12.4753","0.0004","15.7403","0.0005","17.5125","0.0006","70.944","0.002","82.683","0.002","75.308","0.002","3140.38","0.18","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C66 H81 Cl3 F2 N6 P -","- C66 H81 Cl3 F2 N6 P -","- C132 H162 Cl6 F4 N12 P2 -","2","1","","Löwe, Pawel; Witteler, Tim; Dielmann, Fabian","Lewis base-free thiophosphonium ion: a cationic sulfur atom transfer reagent.","Chemical communications (Cambridge, England)","2021","57","41","5043","5046","10.1039/d1cc01273h","","","0.71073","MoKα","","0.0743","0.0565","","","0.1485","0.1615","","","","","","1.035","","","","has coordinates,has disorder","265850","2021-06-05","17:19:32",""
"7128185","12.5153","0.0003","20.6933","0.0004","21.869","0.0005","97.8224","0.001","104.482","0.001","96.7163","0.0011","5365","0.2","100","2","100","","","","","","","","","6","P -1","-P 1","2","","","","- C55.5 H75.5 Cl N6 P S -","- C55.5 H75.5 Cl N6 P S -","- C222 H302 Cl4 N24 P4 S4 -","4","2","","Löwe, Pawel; Witteler, Tim; Dielmann, Fabian","Lewis base-free thiophosphonium ion: a cationic sulfur atom transfer reagent.","Chemical communications (Cambridge, England)","2021","57","41","5043","5046","10.1039/d1cc01273h","","","0.71073","MoKα","","0.0495","0.0406","","","0.104","0.1095","","","","","","1.029","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128186","19.9223","0.0009","28.8141","0.0014","17.4931","0.0007","90","","97.02","0.003","90","","9966.5","0.8","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Na6Fe2(N,N'-bis(3-carboxylate-2-hydroxyphenyl)terephthalamide )3.5DMF.3Acetone.4H2O","","- C90 H97 Fe2 N11 Na6 O36 -","- C90 H97 Fe2 N11 Na6 O36 -","- C360 H388 Fe8 N44 Na24 O144 -","4","1","","Do, Jean-Louis; Titi, Hatem M.; Cuccia, Louis A.; Friščić, Tomislav","A new class of anionic metallohelicates based on salicylic and terephthalic acid units, accessible in solution and by mechanochemistry.","Chemical communications (Cambridge, England)","2021","57","42","5143","5146","10.1039/d0cc08180a","","","1.54178","CuKα","","0.1577","0.1296","","","0.3298","0.3502","","","","","","1.051","","","","has coordinates,has disorder","265864","2021-06-05","17:25:24",""
"7128187","26.6408","0.0015","12.2924","0.0007","22.7172","0.0012","90","","110.066","0.002","90","","6987.8","0.7","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(guanidinium)4Cu2(N,N'-bis(3-carboxylate-2-hydroxyphenyl)terephthalamide )2.H2O.iPrOH","","- C54 H65 Cu2 N16 O19 -","- C54 H65 Cu2 N16 O19 -","- C216 H260 Cu8 N64 O76 -","4","0.5","","Do, Jean-Louis; Titi, Hatem M.; Cuccia, Louis A.; Friščić, Tomislav","A new class of anionic metallohelicates based on salicylic and terephthalic acid units, accessible in solution and by mechanochemistry.","Chemical communications (Cambridge, England)","2021","57","42","5143","5146","10.1039/d0cc08180a","","","1.54178","CuKα","","0.0464","0.0435","","","0.1078","0.1098","","","","","","1.08","","","","has coordinates","265864","2021-06-05","17:25:25",""
"7128188","14.1272","0.0012","14.8356","0.0014","20.795","0.0018","89.584","0.004","74.544","0.003","77.368","0.004","4093","0.6","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","(guanidinium)6Fe2(N,N'-bis(3-carboxylate-2-hydroxyphenyl)terephthalamide )3.7H2O","","- C144 H170 Fe4 N48 O61 -","- C144 H170 Fe4 N48 O61 -","- C144 H170 Fe4 N48 O61 -","1","0.5","","Do, Jean-Louis; Titi, Hatem M.; Cuccia, Louis A.; Friščić, Tomislav","A new class of anionic metallohelicates based on salicylic and terephthalic acid units, accessible in solution and by mechanochemistry.","Chemical communications (Cambridge, England)","2021","57","42","5143","5146","10.1039/d0cc08180a","","","1.54178","CuKα","","0.1383","0.0804","","","0.1596","0.1952","","","","","","1.014","","","","has coordinates,has disorder","265864","2021-06-05","17:25:25",""
"7128189","43.027","0.004","9.8262","0.0008","20.9293","0.0018","90","","107.536","0.004","90","","8437.5","1.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(guanidinium)6Fe2(N,N'-bis(3-carboxylate-2-hydroxyphenyl)terephthalamide )3.4H2O","","- C144 H162 Fe4 N48 O57 -","- C144 H162 Fe4 N48 O57 -","- C288 H324 Fe8 N96 O114 -","2","0.25","","Do, Jean-Louis; Titi, Hatem M.; Cuccia, Louis A.; Friščić, Tomislav","A new class of anionic metallohelicates based on salicylic and terephthalic acid units, accessible in solution and by mechanochemistry.","Chemical communications (Cambridge, England)","2021","57","42","5143","5146","10.1039/d0cc08180a","","","1.54178","CuKα","","0.0992","0.0783","","","0.1909","0.2041","","","","","","1.076","","","","has coordinates,has disorder","265864","2021-06-05","17:25:25",""
"7128190","13.5168","0.0004","30.7906","0.0011","14.0219","0.0005","90","","94.73","0.002","90","","5815.9","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Na4Cu2(N,N'-bis(3-carboxylate-2-hydroxyphenyl)terephthalamide )2.3DMF","","- C53 H47 Cu2 N7 Na4 O20 -","- C53 H47 Cu2 N7 Na4 O20 -","- C212 H188 Cu8 N28 Na16 O80 -","4","1","","Do, Jean-Louis; Titi, Hatem M.; Cuccia, Louis A.; Friščić, Tomislav","A new class of anionic metallohelicates based on salicylic and terephthalic acid units, accessible in solution and by mechanochemistry.","Chemical communications (Cambridge, England)","2021","57","42","5143","5146","10.1039/d0cc08180a","","","1.54178","CuKα","","0.0841","0.0705","","","0.2059","0.2202","","","","","","1.073","","","","has coordinates,has disorder","265864","2021-06-05","17:25:25",""
"7128191","26.172","0.0007","17.389","0.0005","31.5009","0.0008","90","","95.918","0.002","90","","14259.8","0.7","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Na2(NBut4)4Fe2(N,N'-bis(3-carboxylate-2-hydroxyphenyl)terephthalamide )3.DMF","","- C266 H388 Fe4 N22 Na4 O57 -","- C266 H388 Fe4 N22 Na4 O57 -","- C532 H776 Fe8 N44 Na8 O114 -","2","0.5","","Do, Jean-Louis; Titi, Hatem M.; Cuccia, Louis A.; Friščić, Tomislav","A new class of anionic metallohelicates based on salicylic and terephthalic acid units, accessible in solution and by mechanochemistry.","Chemical communications (Cambridge, England)","2021","57","42","5143","5146","10.1039/d0cc08180a","","","1.54178","CuKα","","0.1264","0.0905","","","0.2115","0.2296","","","","","","1.056","","","","has coordinates,has disorder","265864","2021-06-05","17:25:25",""
"7128192","23.0817","0.0005","23.3506","0.0005","10.0089","0.0002","90","","90","","90","","5394.5","0.2","150","2","150","2","","","","","","","","5","P n n 2","P 2 -2n","34","","(H2TMEDA)3Fe2(N,N'-bis(3-carboxylate-2-hydroxyphenyl)terephthalamide )3.DMF","","- C84 H86 Fe2 N12 O26 -","- C84 H86 Fe2 N12 O26 -","- C168 H172 Fe4 N24 O52 -","2","0.5","","Do, Jean-Louis; Titi, Hatem M.; Cuccia, Louis A.; Friščić, Tomislav","A new class of anionic metallohelicates based on salicylic and terephthalic acid units, accessible in solution and by mechanochemistry.","Chemical communications (Cambridge, England)","2021","57","42","5143","5146","10.1039/d0cc08180a","","","1.54178","CuKα","","0.0797","0.0526","","","0.1399","0.1593","","","","","","1.012","","","","has coordinates","265864","2021-06-05","17:25:25",""
"7128193","27.106","0.006","15.46","0.003","46.953","0.01","90","","90","","90","","19676","7","293","2","293","2","","","","","","","","4","P m n a","-P 2ac 2","53","","","","- C170 H262 O91 Sn18 -","- C170 H228 O74 Sn18 -","- C340 H456 O148 Sn36 -","2","0.25","","Zhu, Yu; Li, Qiaohong; Li, Dongsheng; Zhang, Jian; Zhang, Lei","Functional ligand directed assembly and electronic structure of Sn<sub>18</sub>-oxo wheel nanoclusters.","Chemical communications (Cambridge, England)","2021","57","42","5159","5162","10.1039/d1cc00651g","","","0.71073","MoKα","","0.0871","0.0687","","","0.1977","0.2155","","","","","","1.096","","","","has coordinates,has disorder","265863","2021-06-05","17:24:58",""
"7128194","14.2047","0.0015","21.812","0.002","14.6944","0.0015","90","","90.464","0.001","90","","4552.7","0.8","100","","100","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","FeNi_AQDS_H2O_100K","","- C29 H48 Fe N14 Ni2 O11 S -","- C29 H48 Fe N14 Ni2 O11 S -","- C116 H192 Fe4 N56 Ni8 O44 S4 -","4","1","","Yoshino, Haruka; Tomokage, Narumi; Mishima, Akio; Le Ouay, Benjamin; Ohtani, Ryo; Kosaka, Wataru; Miyasaka, Hitoshi; Ohba, Masaaki","Guest-selective and reversible magnetic phase switching in a pseudo-pillared-layer porous magnet.","Chemical communications (Cambridge, England)","2021","57","42","5211","5214","10.1039/d1cc01526e","","","0.71073","MoKα","","0.0599","0.0457","","","0.1212","0.1317","","","","","","1.046","","","","has coordinates,has disorder","265866","2021-06-05","17:25:40",""
"7128195","3.8549","0.0009","11.732","0.002","27.48","0.005","90","","90","","90","","1242.8","0.4","100","2","100.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H8 Br1.25 N0.75 O3.5 -","- C13 H8 Br1.25 N0.75 O3.5 -","- C52 H32 Br5 N3 O14 -","4","1","","Whittaker, Jacob J.; Brock, Aidan J.; Grosjean, Arnaud; Pfrunder, Michael C.; McMurtrie, John C.; Clegg, Jack K.","Comment on ""Trimorphs of 4-bromophenyl 4-bromobenzoate. Elastic, brittle, plastic"" by S. Saha and G. R. Desiraju, <i>Chem. Commun.</i>, 2018, <b>54</b>, 6348.","Chemical communications (Cambridge, England)","2021","57","40","4974","4975","10.1039/d0cc07668f","","","0.71073","MoKα","","0.0508","0.0455","","","0.0953","0.0979","","","","","","1.056","","","","has coordinates,has disorder","265884","2021-06-05","17:29:04",""
"7128196","13.3586","0.0012","14.0431","0.0016","16.711","0.002","109.543","0.005","96.454","0.002","98.884","0.003","2873.2","0.6","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H60 F Ge P3 Pd -","- C72 H60 F Ge P3 Pd -","- C144 H120 F2 Ge2 P6 Pd2 -","2","1","","Kameo, Hajime; Mushiake, Akihiro; Isasa, Tomohito; Matsuzaka, Hiroyuki; Bourissou, Didier","Pd/Ni-Catalyzed Germa-Suzuki coupling <i>via</i> dual Ge-F bond activation.","Chemical communications (Cambridge, England)","2021","57","41","5004","5007","10.1039/d1cc01392k","","","0.710747","MoKα","","0.0614","0.0496","","","0.0955","0.1033","","","","","","1.066","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128197","12.4393","0.0005","18.8866","0.0006","18.6647","0.0008","90","","109.172","0.0016","90","","4141.8","0.3","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H33 F5 Ge P2 Pd -","- C48 H33 F5 Ge P2 Pd -","- C192 H132 F20 Ge4 P8 Pd4 -","4","1","","Kameo, Hajime; Mushiake, Akihiro; Isasa, Tomohito; Matsuzaka, Hiroyuki; Bourissou, Didier","Pd/Ni-Catalyzed Germa-Suzuki coupling <i>via</i> dual Ge-F bond activation.","Chemical communications (Cambridge, England)","2021","57","41","5004","5007","10.1039/d1cc01392k","","","0.7107","MoKα","","0.0551","0.0402","","","0.0831","0.0905","","","","","","1.063","","","","has coordinates","265851","2021-06-05","17:19:47",""
"7128198","20.3098","0.0006","15.2436","0.0004","22.422","0.0007","90","","104.893","0.0013","90","","6708.5","0.3","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C84 H68 B Ge P3 Pd -","- C84 H68 B Ge P3 Pd -","- C336 H272 B4 Ge4 P12 Pd4 -","4","1","","Kameo, Hajime; Mushiake, Akihiro; Isasa, Tomohito; Matsuzaka, Hiroyuki; Bourissou, Didier","Pd/Ni-Catalyzed Germa-Suzuki coupling <i>via</i> dual Ge-F bond activation.","Chemical communications (Cambridge, England)","2021","57","41","5004","5007","10.1039/d1cc01392k","","","0.710747","MoKα","","0.0635","0.0477","","","0.0947","0.1029","","","","","","1.137","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128199","9.191","0.002","18.595","0.004","21.171","0.005","90","","93.617","0.003","90","","3611.1","1.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H33 Cl Ge P2 Pd -","- C42 H33 Cl Ge P2 Pd -","- C168 H132 Cl4 Ge4 P8 Pd4 -","4","1","","Kameo, Hajime; Mushiake, Akihiro; Isasa, Tomohito; Matsuzaka, Hiroyuki; Bourissou, Didier","Pd/Ni-Catalyzed Germa-Suzuki coupling <i>via</i> dual Ge-F bond activation.","Chemical communications (Cambridge, England)","2021","57","41","5004","5007","10.1039/d1cc01392k","","","0.7107","MoKα","","0.0481","0.0407","","","0.0902","0.0948","","","","","","1.132","","","","has coordinates","265851","2021-06-05","17:19:47",""
"7128200","7.059","0.008","19.92","0.02","9.454","0.011","90","","91.125","0.012","90","","1329","3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H19 N O -","- C16 H19 N O -","- C64 H76 N4 O4 -","4","2","","Chen, Jiangfei; Zhu, Yan-Ping; Li, Jin-Heng; Wang, Qiu-An","External-oxidant-free amino-benzoyloxylation of unactivated alkenes of unsaturated ketoximes with O-benzoylhydroxylamines.","Chemical communications (Cambridge, England)","2021","57","42","5215","5218","10.1039/d1cc01565f","","","0.71073","MoKα","","0.1885","0.1241","","","0.3191","0.3636","","","","","","1.053","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128201","6.5441","0.0019","8.977","0.003","28.197","0.008","90","","90","","90","","1656.5","0.9","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H19 N O3 -","- C19 H19 N O3 -","- C76 H76 N4 O12 -","4","1","","Chen, Jiangfei; Zhu, Yan-Ping; Li, Jin-Heng; Wang, Qiu-An","External-oxidant-free amino-benzoyloxylation of unactivated alkenes of unsaturated ketoximes with O-benzoylhydroxylamines.","Chemical communications (Cambridge, England)","2021","57","42","5215","5218","10.1039/d1cc01565f","","","","","","0.044","","","","","","","","","","","","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128202","13.9958","0.0006","7.4192","0.0003","18.5276","0.0008","90","","109.796","0.005","90","","1810.17","0.14","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H29 N O4 S -","- C17 H29 N O4 S -","- C68 H116 N4 O16 S4 -","4","2","","Li, Yibao; Du, Ye; Huang, Chao-Ran; Peng, Hang; Zeng, Yu-Ling; Liu, Jun-Chao; Liao, Wei-Qiang","Homochiral anionic modification toward the chemical design of organic enantiomeric ferroelectrics.","Chemical communications (Cambridge, England)","2021","57","42","5171","5174","10.1039/d1cc01675j","","","0.71073","MoKα","","0.0712","0.0545","","","0.1673","0.1799","","","","","","1.08","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128203","18.6138","0.0003","7.3953","0.0001","14.0162","0.0002","90","","109.918","0.002","90","","1813.98","0.05","298","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H29 N O4 S -","- C17 H29 N O4 S -","- C68 H116 N4 O16 S4 -","4","1","","Li, Yibao; Du, Ye; Huang, Chao-Ran; Peng, Hang; Zeng, Yu-Ling; Liu, Jun-Chao; Liao, Wei-Qiang","Homochiral anionic modification toward the chemical design of organic enantiomeric ferroelectrics.","Chemical communications (Cambridge, England)","2021","57","42","5171","5174","10.1039/d1cc01675j","","","1.54178","CuKα","","0.12","0.1097","","","0.3184","0.3322","","","","","","1.004","","","","has coordinates","265870","2021-06-05","17:26:21",""
"7128204","7.0131","0.0007","7.1214","0.0005","19.477","0.0017","90","","93.127","0.008","90","","971.29","0.15","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H15 N O4 S -","- C7 H15 N O4 S -","- C28 H60 N4 O16 S4 -","4","1","","Li, Yibao; Du, Ye; Huang, Chao-Ran; Peng, Hang; Zeng, Yu-Ling; Liu, Jun-Chao; Liao, Wei-Qiang","Homochiral anionic modification toward the chemical design of organic enantiomeric ferroelectrics.","Chemical communications (Cambridge, England)","2021","57","42","5171","5174","10.1039/d1cc01675j","","","0.71073","MoKα","","0.0834","0.0545","","","0.1384","0.1537","","","","","","1.075","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128205","14.0095","0.0002","7.4162","0.0001","18.5511","0.0002","90","","109.791","0.002","90","","1813.56","0.05","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H29 N O4 S -","- C17 H29 N O4 S -","- C68 H116 N4 O16 S4 -","4","2","","Li, Yibao; Du, Ye; Huang, Chao-Ran; Peng, Hang; Zeng, Yu-Ling; Liu, Jun-Chao; Liao, Wei-Qiang","Homochiral anionic modification toward the chemical design of organic enantiomeric ferroelectrics.","Chemical communications (Cambridge, England)","2021","57","42","5171","5174","10.1039/d1cc01675j","","","1.54178","CuKα","","0.0653","0.0581","","","0.1674","0.1864","","","","","","0.991","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128206","9.9343","0.0004","23.4616","0.0011","22.0737","0.0012","90","","91.875","0.005","90","","5142.1","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H70 Li N4 P7 Si2 -","- C44 H70 Li N4 P7 Si2 -","- C176 H280 Li4 N16 P28 Si8 -","4","1","","Boronski, Josef T.; Seed, John A.; Wooles, Ashley J.; Liddle, Stephen T.","Fragmentation, catenation, and direct functionalisation of white phosphorus by a uranium(IV)-silyl-phosphino-carbene complex.","Chemical communications (Cambridge, England)","2021","57","41","5090","5093","10.1039/d1cc01741a","","x-ray","1.54184","CuKα","","0.0993","0.0686","","","0.1798","0.201","","","","","","1.04","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128207","12.67099","0.00017","21.463","0.0002","16.66143","0.00017","90","","93.0428","0.0011","90","","4524.81","0.09","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C37 H54 Cl3 Li N4 P2 Si2 U -","- C37 H54 Cl3 Li N4 P2 Si2 U -","- C148 H216 Cl12 Li4 N16 P8 Si8 U4 -","4","1","","Boronski, Josef T.; Seed, John A.; Wooles, Ashley J.; Liddle, Stephen T.","Fragmentation, catenation, and direct functionalisation of white phosphorus by a uranium(IV)-silyl-phosphino-carbene complex.","Chemical communications (Cambridge, England)","2021","57","41","5090","5093","10.1039/d1cc01741a","","x-ray","1.54184","CuKα","","0.047","0.0453","","","0.1223","0.124","","","","","","1.023","","","","has coordinates,has disorder","265854","2021-06-05","17:21:37",""
"7128208","13.8687","0.0002","14.1074","0.0003","15.5642","0.0002","113.276","0.002","106.911","0.001","90.138","0.001","2652.39","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C106 H126 N4 P10 Si6 U2 -","- C106 H126 N4 P10 Si6 U2 -","- C106 H126 N4 P10 Si6 U2 -","1","0.5","","Boronski, Josef T.; Seed, John A.; Wooles, Ashley J.; Liddle, Stephen T.","Fragmentation, catenation, and direct functionalisation of white phosphorus by a uranium(IV)-silyl-phosphino-carbene complex.","Chemical communications (Cambridge, England)","2021","57","41","5090","5093","10.1039/d1cc01741a","","x-ray","1.54184","CuKα","","0.025","0.0247","","","0.0691","0.0693","","","","","","1.113","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128209","18.6755","0.0011","12.397","0.0005","8.8081","0.0004","90","","113.055","0.001","90","","1876.38","0.16","100","","100","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Th(ITA)4","","- C32 H64 N4 O4 Th -","- C32 H64 N4 O4 Th -","- C64 H128 N8 O8 Th2 -","2","0.25","","Straub, Mark D.; Ouellette, Erik T.; Boreen, Michael A.; Branson, Jacob A.; Ditter, Alex; Kilcoyne, A. L. David; Lohrey, Trevor D.; Marcus, Matthew A.; Paley, Maria; Ramirez, José; Shuh, David K.; Minasian, Stefan G.; Arnold, John","Thorium amidates function as single-source molecular precursors for thorium dioxide.","Chemical communications (Cambridge, England)","2021","57","40","4954","4957","10.1039/d1cc00867f","","","0.7288","synchrotron","","0.0187","0.0187","","","0.0477","0.0477","","","","","","1.042","","","","has coordinates,has disorder","265886","2021-06-05","17:29:21",""
"7128210","26.5272","0.0017","11.0968","0.0007","21.0598","0.0013","90","","107.646","0.004","90","","5907.6","0.7","100","2","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Th(TPTA)4","","- C60 H88 N4 O4 Th -","- C60 H88 N4 O4 Th -","- C240 H352 N16 O16 Th4 -","4","0.5","","Straub, Mark D.; Ouellette, Erik T.; Boreen, Michael A.; Branson, Jacob A.; Ditter, Alex; Kilcoyne, A. L. David; Lohrey, Trevor D.; Marcus, Matthew A.; Paley, Maria; Ramirez, José; Shuh, David K.; Minasian, Stefan G.; Arnold, John","Thorium amidates function as single-source molecular precursors for thorium dioxide.","Chemical communications (Cambridge, England)","2021","57","40","4954","4957","10.1039/d1cc00867f","","","0.7288","synchrotron","","0.067","0.0646","","","0.1532","0.1547","","","","","","1.489","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128211","10.7799","0.0002","14.0321","0.0003","22.2223","0.0005","90","","102.024","0.002","90","","3287.7","0.12","100","2","100","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","Th(ArFTA)4","","- C58 H62 F24 N4 O4 Th -","- C58 H62 F24 N4 O4 Th -","- C116 H124 F48 N8 O8 Th2 -","2","0.5","","Straub, Mark D.; Ouellette, Erik T.; Boreen, Michael A.; Branson, Jacob A.; Ditter, Alex; Kilcoyne, A. L. David; Lohrey, Trevor D.; Marcus, Matthew A.; Paley, Maria; Ramirez, José; Shuh, David K.; Minasian, Stefan G.; Arnold, John","Thorium amidates function as single-source molecular precursors for thorium dioxide.","Chemical communications (Cambridge, England)","2021","57","40","4954","4957","10.1039/d1cc00867f","","x-ray","0.71073","MoKα","","0.0244","0.0219","","","0.0535","0.0543","","","","","","1.045","","","","has coordinates,has disorder","265886","2021-06-05","17:29:21",""
"7128212","20.547","0.003","24.403","0.003","31.283","0.004","99.271","0.002","107.416","0.002","107.007","0.002","13770","3","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C108 Mo12 O80 Si Zr12 -","- C108 Mo12 O80 Si Zr12 -","- C216 Mo24 O160 Si2 Zr24 -","2","1","","Le Ouay, Benjamin; Yoshino, Haruka; Sasaki, Kenta; Ohtsubo, Yuta; Ohtani, Ryo; Ohba, Masaaki","Crystalline assembly of metal-organic polyhedra driven by ionic interactions with polyoxometalates.","Chemical communications (Cambridge, England)","2021","57","42","5187","5190","10.1039/d1cc01185e","","","0.71073","MoKα","","0.103","0.0811","","","0.2189","0.2322","","","","","","1.095","","","","has coordinates","265867","2021-06-05","17:25:57",""
"7128213","23.393","0.006","24.882","0.006","29.501","0.007","99.888","0.003","102.172","0.003","107.063","0.003","15537","7","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C108 O80 Si W12 Zr12 -","- C108 O80 Si W12 Zr12 -","- C216 O160 Si2 W24 Zr24 -","2","1","","Le Ouay, Benjamin; Yoshino, Haruka; Sasaki, Kenta; Ohtsubo, Yuta; Ohtani, Ryo; Ohba, Masaaki","Crystalline assembly of metal-organic polyhedra driven by ionic interactions with polyoxometalates.","Chemical communications (Cambridge, England)","2021","57","42","5187","5190","10.1039/d1cc01185e","","","0.71073","MoKα","","0.1823","0.136","","","0.3261","0.3773","","","","","","1.092","","","","has coordinates","265867","2021-06-05","17:25:58",""
"7128214","12.435","0.003","12.435","0.003","15.058","0.004","90","","90","","120","","2016.5","0.9","100","2","100","2","","","","","","","","5","P 3 1 c","P 3 -2c","159","","","","- C32.5 H66 Cl7 Cr3 O6 -","- C24.9999 H48 Cl6.9999 Cr3 O6 -","- C49.9998 H96 Cl13.9998 Cr6 O12 -","2","0.333333","","Kurogi, Takashi; Irifune, Keiichi; Enoki, Takahiro; Takai, Kazuhiko","A trinuclear chromium(iii) chlorocarbyne.","Chemical communications (Cambridge, England)","2021","57","42","5199","5202","10.1039/d1cc01514a","","","0.71075","MoKα","","0.0703","0.0623","","","0.1868","0.1955","","","","","","1.12","","","","has coordinates,has disorder","265871","2021-06-05","17:26:31",""
"7128215","11.454","0.005","12.317","0.006","14.321","0.008","106.405","0.006","102.357","0.007","92.041","0.006","1883.3","1.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H53 Cl6 Cr3 O6.5 -","- C25 H49 Cl6 Cr3 O6 -","- C50 H98 Cl12 Cr6 O12 -","2","1","","Kurogi, Takashi; Irifune, Keiichi; Enoki, Takahiro; Takai, Kazuhiko","A trinuclear chromium(iii) chlorocarbyne.","Chemical communications (Cambridge, England)","2021","57","42","5199","5202","10.1039/d1cc01514a","","","0.71075","MoKα","","0.0747","0.0538","","","0.1252","0.1395","","","","","","1.023","","","","has coordinates,has disorder","265871","2021-06-05","17:26:32",""
"7128216","14.106","0.005","16.474","0.006","16.918","0.006","110.075","0.004","97.234","0.002","110.542","0.004","3319","2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H81 Cl13 Cr6 O11 -","- C34 H65 Cl13 Cr6 O9 -","- C68 H130 Cl26 Cr12 O18 -","2","1","","Kurogi, Takashi; Irifune, Keiichi; Enoki, Takahiro; Takai, Kazuhiko","A trinuclear chromium(iii) chlorocarbyne.","Chemical communications (Cambridge, England)","2021","57","42","5199","5202","10.1039/d1cc01514a","","","0.71075","MoKα","","0.0853","0.0682","","","0.1734","0.1941","","","","","","1.147","","","","has coordinates,has disorder","265871","2021-06-05","17:26:32",""
"7128217","10.107","0.003","18.184","0.005","19.257","0.005","90","","93.951","0.004","90","","3530.7","1.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H48 Cl7 Cr3 O6 -","- C25 H48 Cl7 Cr3 O6 -","- C100 H192 Cl28 Cr12 O24 -","4","1","","Kurogi, Takashi; Irifune, Keiichi; Enoki, Takahiro; Takai, Kazuhiko","A trinuclear chromium(iii) chlorocarbyne.","Chemical communications (Cambridge, England)","2021","57","42","5199","5202","10.1039/d1cc01514a","","","0.71075","MoKα","","0.0916","0.0777","","","0.1753","0.1845","","","","","","1.203","","","","has coordinates,has disorder","265871","2021-06-05","17:26:32",""
"7128218","9.3876","0.0003","11.0428","0.0003","15.2827","0.0005","90","","102.186","0.002","90","","1548.59","0.08","170","","170","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H28 Ag2 F12 N4 P2 -","- C24 H28 Ag2 F12 N4 P2 -","- C48 H56 Ag4 F24 N8 P4 -","2","0.5","","Ward, Jas S.; Frontera, Antonio; Rissanen, Kari","Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes.","Chemical communications (Cambridge, England)","2021","57","41","5094","5097","10.1039/d1cc01505b","","","0.71073","MoKα","","0.0477","0.0345","","","0.072","0.0763","","","","","","1.038","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128219","11.6037","0.0005","12.4587","0.0003","22.322","0.0009","90","","90","","90","","3227","0.2","170","","170","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H14 F6 I N2 P -","- C12 H14 F6 I N2 P -","- C96 H112 F48 I8 N16 P8 -","8","1","","Ward, Jas S.; Frontera, Antonio; Rissanen, Kari","Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes.","Chemical communications (Cambridge, England)","2021","57","41","5094","5097","10.1039/d1cc01505b","","","0.71073","MoKα","","0.0621","0.0404","","","0.1037","0.1222","","","","","","1.126","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128220","10.8641","0.0003","11.1767","0.0002","15.0419","0.0004","90","","108.62","0.001","90","","1730.86","0.07","170","","170","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 Ag F6 N2 P -","- C14 H18 Ag F6 N2 P -","- C56 H72 Ag4 F24 N8 P4 -","4","1","","Ward, Jas S.; Frontera, Antonio; Rissanen, Kari","Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes.","Chemical communications (Cambridge, England)","2021","57","41","5094","5097","10.1039/d1cc01505b","","","0.71073","MoKα","","0.0598","0.0435","","","0.0971","0.1036","","","","","","1.047","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128221","11.8384","0.0006","10.2312","0.0004","15.1646","0.0006","90","","109.654","0.005","90","","1729.74","0.14","120","0.1","120","0.1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 Ag0.26 F6 I0.74 N2 P -","- C14 H18 Ag0.26 F6 I0.74 N2 P -","- C56 H72 Ag1.04 F24 I2.96 N8 P4 -","4","0.5","","Ward, Jas S.; Frontera, Antonio; Rissanen, Kari","Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes.","Chemical communications (Cambridge, England)","2021","57","41","5094","5097","10.1039/d1cc01505b","","x-ray","1.54184","CuKα","","0.0384","0.038","","","0.1015","0.1026","","","","","","1.1","","","","has coordinates,has disorder","265853","2021-06-05","17:21:25",""
"7128222","11.7938","0.0003","10.2841","0.0002","15.1354","0.0003","90","","109.149","0.002","90","","1734.18","0.07","120.01","0.1","120.01","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 F6 I N2 P -","- C14 H18 F6 I N2 P -","- C56 H72 F24 I4 N8 P4 -","4","0.5","","Ward, Jas S.; Frontera, Antonio; Rissanen, Kari","Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes.","Chemical communications (Cambridge, England)","2021","57","41","5094","5097","10.1039/d1cc01505b","","x-ray","1.54184","CuKα","","0.0212","0.021","","","0.0538","0.0542","","","","","","1.085","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128223","17.9543","0.001","20.8051","0.001","26.6647","0.001","100.468","0.004","94.508","0.004","106.703","0.005","9290.4","0.8","120","0.1","120","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C16 H22 F6 I N2 P -","- C16 H22 F6 I N2 P -","- C288 H396 F108 I18 N36 P18 -","18","9","","Ward, Jas S.; Frontera, Antonio; Rissanen, Kari","Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes.","Chemical communications (Cambridge, England)","2021","57","41","5094","5097","10.1039/d1cc01505b","","x-ray","1.54184","CuKα","","0.1845","0.1163","","","0.2909","0.3445","","","","","","1.024","","","","has coordinates,has disorder","265853","2021-06-05","17:21:25",""
"7128224","6.9897","0.0001","43.9504","0.0004","20.8689","0.0003","90","","94.294","0.001","90","","6392.93","0.14","120.01","0.1","120.01","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H28 Ag F12 I N4 P2 -","- C24 H28 Ag F12 I N4 P2 -","- C192 H224 Ag8 F96 I8 N32 P16 -","8","2","","Ward, Jas S.; Frontera, Antonio; Rissanen, Kari","Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes.","Chemical communications (Cambridge, England)","2021","57","41","5094","5097","10.1039/d1cc01505b","","x-ray","1.54184","CuKα","","0.0609","0.0555","","","0.1458","0.1506","","","","","","1.04","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128225","10.2094","0.0002","10.2353","0.0003","19.2604","0.0004","100.476","0.002","102.846","0.002","91.053","0.002","1925.92","0.08","120.01","0.1","120.01","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C16 H22 Ag F6 N2 P -","- C16 H22 Ag F6 N2 P -","- C64 H88 Ag4 F24 N8 P4 -","4","2","","Ward, Jas S.; Frontera, Antonio; Rissanen, Kari","Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes.","Chemical communications (Cambridge, England)","2021","57","41","5094","5097","10.1039/d1cc01505b","","x-ray","1.54184","CuKα","","0.0268","0.0244","","","0.062","0.0639","","","","","","1.035","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128226","9.6552","0.0007","17.3124","0.0013","15.8733","0.0013","90","","99.979","0.007","90","","2613.2","0.4","293","","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54.5 H78 Cl4 N2 Zn2 -","- C44 H66 Cl4 N2 Zn2 -","- C88 H132 Cl8 N4 Zn4 -","2","0.5","","Rajendran, N. M.; Gautam, Nimisha; Sarkar, Pallavi; Ahmed, Jasimuddin; Das, Arpan; Das, Shubhajit; Pati, Swapan K.; Mandal, Swadhin K.","Bicyclic (alkyl)(amino)carbene stabilized zinc(0) complex with singlet biradicaloid ground state.","Chemical communications (Cambridge, England)","2021","57","43","5282","5285","10.1039/d1cc01298c","","","0.71073","MoKα","","0.0647","0.0497","","","0.1288","0.1447","","","","","","1.034","","","","has coordinates,has disorder","265858","2021-06-05","17:24:15",""
"7128227","9.85","0.0004","12.5419","0.0005","16.7728","0.0006","79.912","0.003","85.521","0.003","70.669","0.004","1924.57","0.14","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C88 H132 N4 Zn2 -","- C88 H132 N4 Zn2 -","- C88 H132 N4 Zn2 -","1","0.5","","Rajendran, N. M.; Gautam, Nimisha; Sarkar, Pallavi; Ahmed, Jasimuddin; Das, Arpan; Das, Shubhajit; Pati, Swapan K.; Mandal, Swadhin K.","Bicyclic (alkyl)(amino)carbene stabilized zinc(0) complex with singlet biradicaloid ground state.","Chemical communications (Cambridge, England)","2021","57","43","5282","5285","10.1039/d1cc01298c","","","1.54184","CuKα","","0.0572","0.0472","","","0.1041","0.1085","","","","","","1.142","","","","has coordinates,has disorder","265858","2021-06-05","17:24:15",""
"7128228","40.5682","0.0004","14.3248","0.0001","21.1084","0.0002","90","","98.962","0.001","90","","12117","0.19","100","0.1","100","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C60 H49 B F20 Mg N2 -","- C60 H49 B F20 Mg N2 -","- C480 H392 B8 F160 Mg8 N16 -","8","1","","Thum, Katharina; Pahl, Jürgen; Eyselein, Jonathan; Elsen, Holger; Langer, Jens; Harder, Sjoerd","Retro-Diels-Alder decomposition of norbornadiene mediated by a cationic magnesium complex.","Chemical communications (Cambridge, England)","2021","57","43","5278","5281","10.1039/d1cc01691a","","x-ray","1.54184","CuKα","","0.0443","0.0393","","","0.0947","0.0977","","","","","","1.025","","","","has coordinates","265857","2021-06-05","17:24:06",""
"7128229","14.1185","0.0003","25.0351","0.0005","25.6684","0.0005","111.804","0.0019","101.01","0.0017","100.407","0.0016","7947.3","0.3","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C174 H174 B2 F40 Mg4 N8 -","- C174 H174 B2 F40 Mg4 N8 -","- C348 H348 B4 F80 Mg8 N16 -","2","1","","Thum, Katharina; Pahl, Jürgen; Eyselein, Jonathan; Elsen, Holger; Langer, Jens; Harder, Sjoerd","Retro-Diels-Alder decomposition of norbornadiene mediated by a cationic magnesium complex.","Chemical communications (Cambridge, England)","2021","57","43","5278","5281","10.1039/d1cc01691a","","x-ray","1.54184","CuKα","","0.0676","0.0485","","","0.13","0.1433","","","","","","1.02","","","","has coordinates,has disorder","265857","2021-06-05","17:24:06",""
"7128230","9.2377","0.0004","12.4708","0.0007","13.7451","0.0006","74.655","0.004","87.535","0.004","78.126","0.004","1494.22","0.13","100","0.2","100","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H46 Mg N2 -","- C34 H46 Mg N2 -","- C68 H92 Mg2 N4 -","2","1","","Thum, Katharina; Pahl, Jürgen; Eyselein, Jonathan; Elsen, Holger; Langer, Jens; Harder, Sjoerd","Retro-Diels-Alder decomposition of norbornadiene mediated by a cationic magnesium complex.","Chemical communications (Cambridge, England)","2021","57","43","5278","5281","10.1039/d1cc01691a","","","1.54184","CuKα","","0.0549","0.0509","","","0.1335","0.1384","","","","","","1.046","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128231","12.6804","0.0004","16.3144","0.0005","22.7319","0.0007","90.874","0.002","90.208","0.003","92.266","0.003","4698.4","0.3","100","0.2","100","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C99 H97 B F22 Mg2 N4 -","- C99 H97 B F22 Mg2 N4 -","- C198 H194 B2 F44 Mg4 N8 -","2","1","","Thum, Katharina; Pahl, Jürgen; Eyselein, Jonathan; Elsen, Holger; Langer, Jens; Harder, Sjoerd","Retro-Diels-Alder decomposition of norbornadiene mediated by a cationic magnesium complex.","Chemical communications (Cambridge, England)","2021","57","43","5278","5281","10.1039/d1cc01691a","","","1.54184","CuKα","","0.0492","0.0436","","","0.1133","0.1191","","","","","","1.014","","","","has coordinates,has disorder","265857","2021-06-05","17:24:06",""
"7128232","15.9261","0.0002","20.4561","0.0002","17.1852","0.0002","90","","106.937","0.0014","90","","5355.86","0.11","100","0.1","100","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C58 H47 B F20 Mg N2 -","- C58 H47 B F20 Mg N2 -","- C232 H188 B4 F80 Mg4 N8 -","4","1","","Thum, Katharina; Pahl, Jürgen; Eyselein, Jonathan; Elsen, Holger; Langer, Jens; Harder, Sjoerd","Retro-Diels-Alder decomposition of norbornadiene mediated by a cationic magnesium complex.","Chemical communications (Cambridge, England)","2021","57","43","5278","5281","10.1039/d1cc01691a","","x-ray","1.54184","CuKα","","0.0555","0.0406","","","0.0991","0.1082","","","","","","1.035","","","","has coordinates,has disorder","265857","2021-06-05","17:24:06",""
"7128233","12.5647","0.0006","13.9361","0.0006","18.4496","0.0004","97.935","0.003","98.421","0.003","115.012","0.004","2823.1","0.2","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C63 H53 B F20 Mg N2 -","- C63 H53 B F20 Mg N2 -","- C126 H106 B2 F40 Mg2 N4 -","2","1","","Thum, Katharina; Pahl, Jürgen; Eyselein, Jonathan; Elsen, Holger; Langer, Jens; Harder, Sjoerd","Retro-Diels-Alder decomposition of norbornadiene mediated by a cationic magnesium complex.","Chemical communications (Cambridge, England)","2021","57","43","5278","5281","10.1039/d1cc01691a","","x-ray","1.54184","CuKα","","0.057","0.0402","","","0.0965","0.1057","","","","","","1.015","","","","has coordinates,has disorder","265857","2021-06-05","17:24:06",""
"7128234","17.66188","0.00008","20.93276","0.00009","19.46075","0.0001","90","","93.1584","0.0004","90","","7183.94","0.06","100","0.2","100","0.2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C64 H59 Al Cl2 F36 Mg N2 O4 -","- C58 H54 Al Cl F36 Mg N2 O4 -","- C232 H216 Al4 Cl4 F144 Mg4 N8 O16 -","4","1","","Thum, Katharina; Pahl, Jürgen; Eyselein, Jonathan; Elsen, Holger; Langer, Jens; Harder, Sjoerd","Retro-Diels-Alder decomposition of norbornadiene mediated by a cationic magnesium complex.","Chemical communications (Cambridge, England)","2021","57","43","5278","5281","10.1039/d1cc01691a","","x-ray","1.54184","CuKα","","0.0578","0.0549","","","0.1463","0.1489","","","","","","1.032","","","","has coordinates,has disorder","265857","2021-06-05","17:24:06",""
"7128235","19.6397","0.0003","21.7453","0.0003","20.3018","0.0004","90","","90.637","0.002","90","","8669.8","0.2","100","0.1","100","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C79 H87 Al F36 Mg2 N4 O4 -","- C79 H87 Al F36 Mg2 N4 O4 -","- C316 H348 Al4 F144 Mg8 N16 O16 -","4","1","","Thum, Katharina; Pahl, Jürgen; Eyselein, Jonathan; Elsen, Holger; Langer, Jens; Harder, Sjoerd","Retro-Diels-Alder decomposition of norbornadiene mediated by a cationic magnesium complex.","Chemical communications (Cambridge, England)","2021","57","43","5278","5281","10.1039/d1cc01691a","","x-ray","1.54184","CuKα","","0.0759","0.0707","","","0.21","0.2217","","","","","","1.149","","","","has coordinates,has disorder","265857","2021-06-05","17:24:06",""
"7128236","12.8409","0.0015","15.0587","0.0015","12.4189","0.0014","90","","106.043","0.004","90","","2307.9","0.4","296.15","","296.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H9 N3 S -","- C13 H9 N3 S -","- C104 H72 N24 S8 -","8","2","","Ma, Shi-Tang; Zhu, Xiao-Xiao; Xu, Jing-Yu; Li, Ying; Zhang, Xiao-Mei; Feng, Cheng-Tao; Yan, Yizhe","Iodide-promoted transformations of imidazopyridines into sulfur-bridged imidazopyridines or 1,2,4-thiadiazoles.","Chemical communications (Cambridge, England)","2021","57","43","5338","5341","10.1039/d1cc01044a","","","0.71073","MoKα","","0.0777","0.0438","","","0.1023","0.1209","","","","","","1.024","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128237","9.856","0.004","4.9044","0.0018","12.905","0.005","90","","92.965","0.007","90","","623","0.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 N2 -","- C16 H14 N2 -","- C32 H28 N4 -","2","0.5","","Ma, Jin-Tian; Wang, Li-Sheng; Chai, Zhi; Chen, Xin-Feng; Tang, Bo-Cheng; Chen, Xiang-Long; He, Cai; Wu, Yan-Dong; Wu, An-Xin","Access to 2-arylquinazolines <i>via</i> catabolism/reconstruction of amino acids with the insertion of dimethyl sulfoxide.","Chemical communications (Cambridge, England)","2021","57","44","5414","5417","10.1039/d1cc00623a","","","0.71073","MoKα","","0.1493","0.1243","","","0.3495","0.3918","","","","","","1.604","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128238","29.4116","0.0011","6.0927","0.0002","10.9457","0.0003","90","","99.118","0.003","90","","1936.64","0.11","98","2","98","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(1R,2R,6R)-2-(4-methoxyphenyl)-6-[(E)-4-methoxystyryl]-4-oxocyclohexane-1-carbaldehyde","","- C23 H24 O4 -","- C23 H24 O4 -","- C92 H96 O16 -","4","1","","Bora, Pranjal; Jakkampudi, Satish; Parella, Ramarao; Sakkani, Nagaraju; Dai, Qipu; Bihani, Manisha; Arman, Hadi D.; Zhao, John C.-G.","Diastereodivergent synthesis of 4-oxocyclohexanecarbaldehydes by using the modularly designed organocatalysts upon switching on their iminium catalysis.","Chemical communications (Cambridge, England)","2021","57","43","5334","5337","10.1039/d1cc01020d","","x-ray","0.71073","MoKα","","0.072","0.068","","","0.1156","0.1175","","","","","","1.043","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128239","22.889","0.003","38.418","0.006","10.5749","0.0015","90","","90","","90","","9299","2","98","2","98","2","","","","","","","","5","F d d 2","F 2 -2d","43","","2-Benzyl-6-(2-chloro-phenyl)-4-methyl-4-styrl-tetrahydro- pyrrolo[3,4-c]pyrrole-1,3-dione","","- C28 H25 Cl N2 O2 -","- C28 H25 Cl N2 O2 -","- C448 H400 Cl16 N32 O32 -","16","1","","Bora, Pranjal; Jakkampudi, Satish; Parella, Ramarao; Sakkani, Nagaraju; Dai, Qipu; Bihani, Manisha; Arman, Hadi D.; Zhao, John C.-G.","Diastereodivergent synthesis of 4-oxocyclohexanecarbaldehydes by using the modularly designed organocatalysts upon switching on their iminium catalysis.","Chemical communications (Cambridge, England)","2021","57","43","5334","5337","10.1039/d1cc01020d","","","0.71073","MoKα","","0.0429","0.0409","","","0.1093","0.1116","","","","","","1","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128240","21.52","0.0004","5.2234","0.0001","16.801","0.0003","90","","93.046","0.002","90","","1885.89","0.06","100","0.1","100","0.1","","","","","","","","4","C 1 2 1","C 2y","5","","(1R,2R,6S)-2-(4-nitrophenyl)-6-[(E)-4-nitrostyryl]-4-oxocyclohexane-1-carbaldehyde","","- C21 H18 N2 O6 -","- C21 H18 N2 O6 -","- C84 H72 N8 O24 -","4","1","","Bora, Pranjal; Jakkampudi, Satish; Parella, Ramarao; Sakkani, Nagaraju; Dai, Qipu; Bihani, Manisha; Arman, Hadi D.; Zhao, John C.-G.","Diastereodivergent synthesis of 4-oxocyclohexanecarbaldehydes by using the modularly designed organocatalysts upon switching on their iminium catalysis.","Chemical communications (Cambridge, England)","2021","57","43","5334","5337","10.1039/d1cc01020d","","x-ray","1.54184","CuKα","","0.0664","0.0553","","","0.1343","0.1373","","","","","","1.081","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128241","8.81","0.05","17.21","0.1","18.39","0.1","90","","95","0.3","90","","2778","3","100","2","100","2","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C21 H41 B F3 N3 O Si3 -","- C21 H41 B F3 N3 O Si3 -","- C84 H164 B4 F12 N12 O4 Si12 -","4","2","","Parvin, Nasrina; Sen, Nilanjana; Muhasina, Puthan Veetil; Tothadi, Srinu; Parameswaran, Pattiyil; Khan, Shabana","The diverse reactivity of NOBF<sub>4</sub> towards silylene, disilene, germylene and stannylene.","Chemical communications (Cambridge, England)","2021","57","41","5008","5011","10.1039/d1cc01034d","","","0.71073","MoKα","","0.1426","0.0688","","","0.1298","0.1579","","","","","","1.064","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128242","9.356","0.012","9.434","0.012","13.182","0.017","95.79","0.03","106.56","0.03","116.5","0.02","962","2","100","2","100","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H66 F2 N2 Si6 -","- C32 H66 F2 N2 Si6 -","- C32 H66 F2 N2 Si6 -","1","0.5","","Parvin, Nasrina; Sen, Nilanjana; Muhasina, Puthan Veetil; Tothadi, Srinu; Parameswaran, Pattiyil; Khan, Shabana","The diverse reactivity of NOBF<sub>4</sub> towards silylene, disilene, germylene and stannylene.","Chemical communications (Cambridge, England)","2021","57","41","5008","5011","10.1039/d1cc01034d","","","0.71073","MoKα","","0.2559","0.1075","","","0.1847","0.238","","","","","","1.019","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128243","18.85","0.011","8.419","0.005","18.595","0.011","90","","117.495","0.011","90","","2618","3","100","2","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H41 F2 Ge N3 Si2 -","- C21 H41 F2 Ge N3 Si2 -","- C84 H164 F8 Ge4 N12 Si8 -","4","1","","Parvin, Nasrina; Sen, Nilanjana; Muhasina, Puthan Veetil; Tothadi, Srinu; Parameswaran, Pattiyil; Khan, Shabana","The diverse reactivity of NOBF<sub>4</sub> towards silylene, disilene, germylene and stannylene.","Chemical communications (Cambridge, England)","2021","57","41","5008","5011","10.1039/d1cc01034d","","","0.71073","MoKα","","0.1465","0.0662","","","0.1073","0.1339","","","","","","1.017","","","","has coordinates","265852","2021-06-05","17:20:02",""
"7128244","18.489","0.008","8.832","0.004","18.866","0.008","90","","118.897","0.012","90","","2697","2","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H41 F2 N3 Si2 Sn -","- C21 H41 F2 N3 Si2 Sn -","- C84 H164 F8 N12 Si8 Sn4 -","4","1","","Parvin, Nasrina; Sen, Nilanjana; Muhasina, Puthan Veetil; Tothadi, Srinu; Parameswaran, Pattiyil; Khan, Shabana","The diverse reactivity of NOBF<sub>4</sub> towards silylene, disilene, germylene and stannylene.","Chemical communications (Cambridge, England)","2021","57","41","5008","5011","10.1039/d1cc01034d","","","0.71073","MoKα","","0.1109","0.0529","","","0.108","0.1276","","","","","","1.033","","","","has coordinates","265852","2021-06-05","17:20:02",""
"7128245","8.74","0.02","17.01","0.04","18.55","0.03","90","","95.21","0.09","90","","2746","10","100","2","100","","","","","","","","","8","P 1 n 1","P -2yac","7","","","","- C21 H41 B F3 Ge N3 O Si2 -","- C21 H41 B F3 Ge N3 O Si2 -","- C84 H164 B4 F12 Ge4 N12 O4 Si8 -","4","2","","Parvin, Nasrina; Sen, Nilanjana; Muhasina, Puthan Veetil; Tothadi, Srinu; Parameswaran, Pattiyil; Khan, Shabana","The diverse reactivity of NOBF<sub>4</sub> towards silylene, disilene, germylene and stannylene.","Chemical communications (Cambridge, England)","2021","57","41","5008","5011","10.1039/d1cc01034d","","","0.71073","MoKα","","0.1262","0.0675","","","0.1184","0.1409","","","","","","1.026","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128246","17.156","0.0008","17.9049","0.0009","17.405","0.0008","90","","112.89","0.002","90","","4925.4","0.4","100","2","100","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C99 H123 B4 F6 N8 O6 P2 Sn2 -","- C99 H123 B4 F6 N8 O6 P2 Sn2 -","- C198 H246 B8 F12 N16 O12 P4 Sn4 -","2","0.5","","Parvin, Nasrina; Sen, Nilanjana; Muhasina, Puthan Veetil; Tothadi, Srinu; Parameswaran, Pattiyil; Khan, Shabana","The diverse reactivity of NOBF<sub>4</sub> towards silylene, disilene, germylene and stannylene.","Chemical communications (Cambridge, England)","2021","57","41","5008","5011","10.1039/d1cc01034d","","","0.71073","MoKα","","0.1102","0.0659","","","0.1615","0.2126","","","","","","1.157","","","","has coordinates,has disorder","265852","2021-06-05","17:20:02",""
"7128247","18.681","0.007","8.385","0.003","18.595","0.007","90","","116.752","0.009","90","","2601","1.7","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H41 F2 N3 Si3 -","- C21 H41 F2 N3 Si3 -","- C84 H164 F8 N12 Si12 -","4","1","","Parvin, Nasrina; Sen, Nilanjana; Muhasina, Puthan Veetil; Tothadi, Srinu; Parameswaran, Pattiyil; Khan, Shabana","The diverse reactivity of NOBF<sub>4</sub> towards silylene, disilene, germylene and stannylene.","Chemical communications (Cambridge, England)","2021","57","41","5008","5011","10.1039/d1cc01034d","","","0.71073","MoKα","","0.0664","0.0407","","","0.0822","0.0928","","","","","","1.035","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128248","12.5252","0.0019","13.3924","0.0019","19.02","0.003","90.778","0.005","95.203","0.005","106.28","0.005","3047.4","0.8","104","2","104","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H54 N12 O27 Re6 -","- C42 H54 N12 O27 Re6 -","- C84 H108 N24 O54 Re12 -","2","1","","Ghosh, Rajib; Ghosh, Tamal Kanti; Ghosh, Pradyut","Superiority of a polymeric scavenger over its hexapodal monomer towards efficient ReO<sub>4</sub><sup>-</sup> removal in water.","Chemical communications (Cambridge, England)","2021","57","45","5578","5581","10.1039/d1cc01890f","","","0.71073","MoKα","","0.0986","0.0714","","","0.1746","0.1941","","","","","","1.036","","","","has coordinates","265895","2021-06-05","17:31:45",""
"7128249","9.4904","0.0007","9.8661","0.0007","12.9696","0.0009","71.155","0.002","70.007","0.002","61.631","0.002","985.04","0.12","301","2","300.88","","","","","","","","","5","P 1","P 1","1","","","","- C22 H22 N2 O2 S -","- C22 H22 N2 O2 S -","- C44 H44 N4 O4 S2 -","2","2","","Huang, Lin; Xie, Jia-Hao; Cai, Yue; Zheng, Chao; Hou, Xue-Long; Dai, Li-Xin; You, Shu-Li","Enantioselective synthesis of polycyclic pyrrole derivatives by iridium-catalyzed asymmetric allylic dearomatization and ring-expansive migration reactions.","Chemical communications (Cambridge, England)","2021","57","44","5390","5393","10.1039/d1cc01929e","","","0.71073","MoKα","","0.086","0.0764","","","0.1843","0.2003","","","","","","1.048","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128250","23.5649","0.0002","23.5649","0.0002","23.5649","0.0002","90","","90","","90","","13085.7","0.19","123","2","123","2","","","","","","","","8","P 21 3","P 2ac 2ab 3","198","","","","- C36 H60 Cu4 N12 Na8 O24 Rh4 S12 -","- C36 H60 Cu4 N12 Na8.0001 O24 Rh4 S12 -","- C144 H240 Cu16 N48 Na32.0004 O96 Rh16 S48 -","4","0.333333","","Fukuda, Yosuke; Yoshinari, Nobuto; Yamagami, Kohei; Konno, Takumi","Transformations of empty Cu core to CuCuO and CuS cores <i>via</i> oxide and sulfide insertions.","Chemical communications (Cambridge, England)","2021","57","44","5386","5389","10.1039/d1cc01572a","","x-ray","0.71073","MoKα","","0.0462","0.0384","","","0.1101","0.1151","","","","","","0.991","","","","has coordinates","265836","2021-06-05","17:17:04",""
"7128251","23.6536","0.0015","23.6536","0.0015","23.6536","0.0015","90","","90","","90","","13234","1.5","100","2","100","2","","","","","","","","8","P 21 3","P 2ac 2ab 3","198","","","","- C36 H60 Cu4 N12 Na8 O25 Rh4 S12 -","- C36 H60 Cu4 N12 Na7.9998 O25 Rh4 S12 -","- C144 H240 Cu16 N48 Na31.9992 O100 Rh16 S48 -","4","0.333333","","Fukuda, Yosuke; Yoshinari, Nobuto; Yamagami, Kohei; Konno, Takumi","Transformations of empty Cu core to CuCuO and CuS cores <i>via</i> oxide and sulfide insertions.","Chemical communications (Cambridge, England)","2021","57","44","5386","5389","10.1039/d1cc01572a","","","0.4126","synchrotron","","0.0731","0.0592","","","0.1678","0.1792","","","","","","0.98","","","","has coordinates","265836","2021-06-05","17:17:04",""
"7128252","15.6933","0.0003","29.5973","0.0004","15.8253","0.0003","90","","119.634","0.002","90","","6389.1","0.2","100","2","100","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C36 H60 Cu6 N12 Na3 O36 Rh4 S13 -","- C36 H60 Cu6 N12 Na3 O36 Rh4 S13 -","- C72 H120 Cu12 N24 Na6 O72 Rh8 S26 -","2","1","","Fukuda, Yosuke; Yoshinari, Nobuto; Yamagami, Kohei; Konno, Takumi","Transformations of empty Cu core to CuCuO and CuS cores <i>via</i> oxide and sulfide insertions.","Chemical communications (Cambridge, England)","2021","57","44","5386","5389","10.1039/d1cc01572a","","","0.4126","synchrotron","","0.1056","0.0651","","","0.1468","0.1583","","","","","","0.981","","","","has coordinates,has disorder","265836","2021-06-05","17:17:04",""
"7128253","9.957","0.003","15.514","0.005","19.041","0.006","77.394","0.004","85.946","0.003","71.397","0.003","2720.4","1.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H24 Cl6 N2 O6 -","- C84 H24 Cl6 N2 O6 -","- C168 H48 Cl12 N4 O12 -","2","1","","Hashikawa, Yoshifumi; Kizaki, Kazuro; Murata, Yasujiro","Pressure-induced annulative orifice closure of a cage-opened C<sub>60</sub> derivative.","Chemical communications (Cambridge, England)","2021","57","43","5322","5325","10.1039/d1cc01662h","","","0.71073","MoKα","","0.0748","0.0491","","","0.1194","0.1322","","","","","","1.053","","","","has coordinates,has disorder","265860","2021-06-05","17:24:29",""
"7128254","10.198","0.007","28.838","0.019","17.362","0.011","90","","104.033","0.008","90","","4954","6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C86 H21.62 Cl2 N2 O5.81 -","- C86 H21.616 Cl2 N2 O5.808 -","- C344 H86.464 Cl8 N8 O23.232 -","4","1","","Hashikawa, Yoshifumi; Kizaki, Kazuro; Murata, Yasujiro","Pressure-induced annulative orifice closure of a cage-opened C<sub>60</sub> derivative.","Chemical communications (Cambridge, England)","2021","57","43","5322","5325","10.1039/d1cc01662h","","","0.71073","MoKα","","0.054","0.0406","","","0.101","0.1072","","","","","","1.025","","","","has coordinates,has disorder","265860","2021-06-05","17:24:29",""
"7128255","9.4654","0.0005","11.0784","0.0006","18.2148","0.001","90","","90","","90","","1910.03","0.18","297.5","0.7","297.5","0.7","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H14 F5 P -","- C24 H14 F5 P -","- C96 H56 F20 P4 -","4","1","","Ponce-de-León, Jaime; Infante, Rebeca; Espinet, Pablo","Easy wide scope access to luminescent fluorophosphoranes.","Chemical communications (Cambridge, England)","2021","57","44","5458","5461","10.1039/d1cc00976a","","x-ray","0.71073","MoKα","","0.0703","0.0442","","","0.0825","0.0985","","","","","","1.058","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128256","9.4899","0.0004","11.6773","0.0004","18.4024","0.0006","90","","102.701","0.004","90","","1989.39","0.13","294","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 F P -","- C24 H30 F P -","- C96 H120 F4 P4 -","4","1","","Ponce-de-León, Jaime; Infante, Rebeca; Espinet, Pablo","Easy wide scope access to luminescent fluorophosphoranes.","Chemical communications (Cambridge, England)","2021","57","44","5458","5461","10.1039/d1cc00976a","","x-ray","0.71073","MoKα","","0.0993","0.0561","","","0.1174","0.1469","","","","","","1.046","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128257","8.5949","0.0005","17.1989","0.001","29.961","0.002","90","","90","","90","","4428.9","0.5","219.9","0.4","219.9","0.4","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H22 F9 P -","- C24 H22 F9 P -","- C192 H176 F72 P8 -","8","1","","Ponce-de-León, Jaime; Infante, Rebeca; Espinet, Pablo","Easy wide scope access to luminescent fluorophosphoranes.","Chemical communications (Cambridge, England)","2021","57","44","5458","5461","10.1039/d1cc00976a","","x-ray","0.71073","MoKα","","0.1505","0.071","","","0.1862","0.2309","","","","","","1.041","","","","has coordinates,has disorder","265839","2021-06-05","17:17:28",""
"7128258","23.1307","0.0001","11.0429","0.0001","24.4853","0.0001","90","","97.165","0.001","90","","6205.44","0.07","180","0.1","180","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C33 H57 B O2 -","- C33 H57 B O2 -","- C264 H456 B8 O16 -","8","4","","Sun, Beiqi; Zheng, Sihan; Mo, Fanyang","Transition metal- and light-free radical borylation of alkyl bromides and iodides using silane.","Chemical communications (Cambridge, England)","2021","57","46","5674","5677","10.1039/d1cc02134f","","x-ray","1.54184","CuKα","","0.0607","0.0588","","","0.1656","0.1681","","","","","","1.045","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128259","24.74","0.08","8.05","0.02","25.1","0.09","90","","94.46","0.06","90","","4984","3","150.15","","150.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C53.5 H34 N8 S4 -","- C53.5 H34 N8 S4 -","- C214 H136 N32 S16 -","4","2","","Hong, Juan; Xiao, Xuxian; Liu, Haoliang; Fu, Lin; Wang, Xin-Chang; Zhou, Long; Wang, Xiao-Ye; Qiu, Zijie; Cao, Xiao-Yu; Narita, Akimitsu; Müllen, Klaus; Hu, Yunbin","X-shaped thiadiazole-containing double [7]heterohelicene with strong chiroptical response and π-stacked homochiral assembly.","Chemical communications (Cambridge, England)","2021","57","45","5566","5569","10.1039/d1cc01631h","","x-ray","0.71073","MoKα","","0.0861","0.0667","","","0.1761","0.1861","","","","","","1.062","","","","has coordinates","292638","2024-06-28","09:33:36",""
"7128260","12.6199","0.0003","12.6719","0.0003","16.2469","0.0003","89.862","0.001","78.768","0.001","73.099","0.001","2434.27","0.09","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H32 Cl6 N8 O0 S4 -","- C52 H32 Cl6 N8 S4 -","- C104 H64 Cl12 N16 S8 -","2","1","","Hong, Juan; Xiao, Xuxian; Liu, Haoliang; Fu, Lin; Wang, Xin-Chang; Zhou, Long; Wang, Xiao-Ye; Qiu, Zijie; Cao, Xiao-Yu; Narita, Akimitsu; Müllen, Klaus; Hu, Yunbin","X-shaped thiadiazole-containing double [7]heterohelicene with strong chiroptical response and π-stacked homochiral assembly.","Chemical communications (Cambridge, England)","2021","57","45","5566","5569","10.1039/d1cc01631h","","","0.71073","MoKα","","0.172","0.0879","","","0.2369","0.2898","","","","","","1.033","","","","has coordinates","265897","2021-06-05","17:32:27",""
"7128261","15.056","0.003","16.373","0.003","19.923","0.004","94.827","0.014","107.933","0.012","94.992","0.013","4622.9","1.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C101 H70 Cl2 N16 S8 -","- C101 H70 Cl2 N16 S8 -","- C202 H140 Cl4 N32 S16 -","2","1","","Hong, Juan; Xiao, Xuxian; Liu, Haoliang; Fu, Lin; Wang, Xin-Chang; Zhou, Long; Wang, Xiao-Ye; Qiu, Zijie; Cao, Xiao-Yu; Narita, Akimitsu; Müllen, Klaus; Hu, Yunbin","X-shaped thiadiazole-containing double [7]heterohelicene with strong chiroptical response and π-stacked homochiral assembly.","Chemical communications (Cambridge, England)","2021","57","45","5566","5569","10.1039/d1cc01631h","","","0.71073","MoKα","","0.2487","0.084","","","0.168","0.2147","","","","","","0.852","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128262","24.3648","0.0009","9.5584","0.0004","25.854","0.001","90","","94.315","0.007","90","","6004","0.4","100","","100.15","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C79 H56 O12 -","- C79 H56 O12 -","- C316 H224 O48 -","4","1","","Kasahara, Yotaro; Hisaki, Ichiro; Akutagawa, Tomoyuki; Takeda, Takashi","Fluorescent molecular glass based on hexadehydrotribenzo[12]annulene.","Chemical communications (Cambridge, England)","2021","57","44","5374","5377","10.1039/d1cc01356d","","","1.54187","CuKα","","0.1689","0.0973","","","0.2507","0.3107","","","","","","1.033","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128263","14.3651","0.0012","10.7385","0.001","13.3772","0.0013","90","","94.475","0.006","90","","2057.3","0.3","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H19 Br O2 -","- C27 H19 Br O2 -","- C108 H76 Br4 O8 -","4","1","","Jiang, Chengzhou; Wu, Jiamin; Han, Jiabin; Chen, Kai; Qian, Yang; Zhang, Zhengyu; Jiang, Yaojia","An expedient synthesis of highly functionalized 1,3-dienes by employing cyclopropenes as <i>C</i><sub>4</sub> units.","Chemical communications (Cambridge, England)","2021","57","46","5710","5713","10.1039/d1cc01254a","","","0.71073","MoKα","","0.1379","0.0868","","","0.1579","0.1735","","","","","","1.185","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128264","12.789","0.003","10.573","0.002","13.888","0.003","90","","101.041","0.006","90","","1843.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 N O3 -","- C23 H23 N O3 -","- C92 H92 N4 O12 -","4","1","","Patil, Vaibhav B.; Nanubolu, Jagadeesh Babu; Chegondi, Rambabu","Design, synthesis and application of spiro[4.5]cyclohexadienones <i>via</i> one-pot sequential <i>p</i>-hydroxybenzylation/oxidative dearomatization.","Chemical communications (Cambridge, England)","2021","57","45","5574","5577","10.1039/d1cc01752g","","","0.71073","MoKα","","0.0587","0.0463","","","0.1193","0.1311","","","","","","1.029","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128265","7.543","0.005","7.946","0.006","16.011","0.011","94.693","0.017","95.845","0.013","97.337","0.014","942.5","1.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H23 N O4 -","- C22 H23 N O4 -","- C44 H46 N2 O8 -","2","1","","Patil, Vaibhav B.; Nanubolu, Jagadeesh Babu; Chegondi, Rambabu","Design, synthesis and application of spiro[4.5]cyclohexadienones <i>via</i> one-pot sequential <i>p</i>-hydroxybenzylation/oxidative dearomatization.","Chemical communications (Cambridge, England)","2021","57","45","5574","5577","10.1039/d1cc01752g","","","0.71073","MoKα","","0.0684","0.0502","","","0.1284","0.1408","","","","","","1.039","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128266","8.496","0.003","14.455","0.005","11.052","0.004","90","","95.66","0.005","90","","1350.7","0.8","93","","93","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H38 Cl4 Ir2 O2 -","- C24 H36 Cl4 Ir2 O2 -","- C48 H72 Cl8 Ir4 O4 -","2","0.5","","Nakamura, Hitomi; Yoshida, Minori; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito","Oxy-tethered Cp*Ir(III) complex as a competent catalyst for selective dehydrogenation from formic acid.","Chemical communications (Cambridge, England)","2021","57","45","5534","5537","10.1039/d1cc01712h","","","0.71075","MoKα","","","0.0353","","","","0.0923","","","","","","1.003","","","","has coordinates","265896","2021-06-05","17:32:02",""
"7128267","8.3245","0.0011","19.219","0.003","20.158","0.003","90","","90","","90","","3225","0.8","93","","93","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C32 H33 Cl F5 N2 O3 Rh S -","- C32 H32 Cl F5 N2 O3 Rh S -","- C128 H128 Cl4 F20 N8 O12 Rh4 S4 -","4","1","","Nakamura, Hitomi; Yoshida, Minori; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito","Oxy-tethered Cp*Ir(III) complex as a competent catalyst for selective dehydrogenation from formic acid.","Chemical communications (Cambridge, England)","2021","57","45","5534","5537","10.1039/d1cc01712h","","","0.71075","MoKα","","","0.0396","","","","0.1008","","","","","","1","","","","has coordinates","265896","2021-06-05","17:32:11",""
"7128268","8.051","0.003","20.321","0.007","20.535","0.006","90","","90","","90","","3360","2","93","","93","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C33 H34 Cl3 F4 N2 O3 Rh S -","- C33 H34 Cl3 F4 N2 O3 Rh S -","- C132 H136 Cl12 F16 N8 O12 Rh4 S4 -","4","1","","Nakamura, Hitomi; Yoshida, Minori; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito","Oxy-tethered Cp*Ir(III) complex as a competent catalyst for selective dehydrogenation from formic acid.","Chemical communications (Cambridge, England)","2021","57","45","5534","5537","10.1039/d1cc01712h","","","0.71075","MoKα","","","0.076","","","","0.1633","","","","","","1","","","","has coordinates","265896","2021-06-05","17:32:11",""
"7128269","7.886","0.0016","19.686","0.004","20.376","0.004","90","","90","","90","","3163.2","1.1","93","","93","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C32 H30 Cl F4 Ir N2 O3 S -","- C32 H30 Cl F4 Ir N2 O3 S -","- C128 H120 Cl4 F16 Ir4 N8 O12 S4 -","4","1","","Nakamura, Hitomi; Yoshida, Minori; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito","Oxy-tethered Cp*Ir(III) complex as a competent catalyst for selective dehydrogenation from formic acid.","Chemical communications (Cambridge, England)","2021","57","45","5534","5537","10.1039/d1cc01712h","","","0.71075","MoKα","","","0.0402","","","","0.1083","","","","","","1.007","","","","has coordinates","265896","2021-06-05","17:32:11",""
"7128270","8.17","0.002","15.036","0.004","27.939","0.007","90","","90","","90","","3432.1","1.5","93","","93","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C33 H35 Cl3 F5 Ir N2 O3 S -","- C33 H35 Cl3 F5 Ir N2 O3 S -","- C132 H140 Cl12 F20 Ir4 N8 O12 S4 -","4","1","","Nakamura, Hitomi; Yoshida, Minori; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito","Oxy-tethered Cp*Ir(III) complex as a competent catalyst for selective dehydrogenation from formic acid.","Chemical communications (Cambridge, England)","2021","57","45","5534","5537","10.1039/d1cc01712h","","","0.71075","MoKα","","","0.0353","","","","0.0856","","","","","","1","","","","has coordinates","265896","2021-06-05","17:32:11",""
"7128271","7.9971","0.0011","11.5082","0.0019","32.026","0.005","90","","90","","90","","2947.4","0.8","93","","93","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C30 H29 Cl F5 N2 O2 Rh S -","- C30 H29 Cl F5 N2 O2 Rh S -","- C120 H116 Cl4 F20 N8 O8 Rh4 S4 -","4","1","","Nakamura, Hitomi; Yoshida, Minori; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito","Oxy-tethered Cp*Ir(III) complex as a competent catalyst for selective dehydrogenation from formic acid.","Chemical communications (Cambridge, England)","2021","57","45","5534","5537","10.1039/d1cc01712h","","","0.71075","MoKα","","0.0539","0.0471","","","0.1089","0.1137","","","","","","1.016","","","","has coordinates","265896","2021-06-05","17:32:11",""
"7128272","11.0733","0.0007","8.0039","0.0004","24.5775","0.0011","90","","99.546","0.005","90","","2148.1","0.2","150","0.1","150","0.1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36 H26 B Cl2 O6 S16 -","- C36 H26 B Cl2 O6 S16 -","- C72 H52 B2 Cl4 O12 S32 -","2","1","","Blundell, Toby J.; Brannan, Michael; Nishimoto, Hiroshi; Kadoya, Tomofumi; Yamada, Jun-Ichi; Akutsu, Hiroki; Nakazawa, Yasuhiro; Martin, Lee","Chiral metal down to 4.2 K - a BDH-TTP radical-cation salt with spiroboronate anion B(2-chloromandelate)<sub>2</sub><sup/>.","Chemical communications (Cambridge, England)","2021","57","44","5406","5409","10.1039/d1cc01441b","","x-ray","0.71073","MoKα","","0.0476","0.0402","","","0.0846","0.0886","","","","","","1.04","","","","has coordinates,has disorder","265838","2021-06-05","17:17:19",""
"7128273","11.556","0.0005","7.8413","0.0003","14.0984","0.0007","90","","109.338","0.005","90","","1205.44","0.1","123","","123","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C20 H22 Cl3 N4 O4 Rh -","- C20 H22 Cl3 N4 O4 Rh -","- C40 H44 Cl6 N8 O8 Rh2 -","2","0.5","","Yatabe, Takeshi; Kamitakahara, Kazuki; Higashijima, Kaede; Ando, Tatsuya; Matsumoto, Takahiro; Yoon, Ki-Seok; Enomoto, Takao; Ogo, Seiji","Synthesis of acetic acid from CO<sub>2</sub>, CH<sub>3</sub>I and H<sub>2</sub> using a water-soluble electron storage catalyst.","Chemical communications (Cambridge, England)","2021","57","39","4772","4774","10.1039/d1cc01611c","","","0.71073","MoKα","","0.061","0.0501","","","0.1337","0.1405","","","","","","1.081","","","","has coordinates,has disorder","265876","2021-06-05","17:27:16",""
"7128274","8.54","0.003","11.981","0.003","12.495","0.003","96.879","0.005","96.143","0.009","99.625","0.008","1240.8","0.6","93","","93","","","","","","","","","7","P -1","-P 1","2","","","","- C23 H20 F6 I N5 P Rh -","- C23 H20 F6 I N5 P Rh -","- C46 H40 F12 I2 N10 P2 Rh2 -","2","1","","Yatabe, Takeshi; Kamitakahara, Kazuki; Higashijima, Kaede; Ando, Tatsuya; Matsumoto, Takahiro; Yoon, Ki-Seok; Enomoto, Takao; Ogo, Seiji","Synthesis of acetic acid from CO<sub>2</sub>, CH<sub>3</sub>I and H<sub>2</sub> using a water-soluble electron storage catalyst.","Chemical communications (Cambridge, England)","2021","57","39","4772","4774","10.1039/d1cc01611c","","","0.71075","MoKα","","0.0602","0.0436","","","0.1116","0.1183","","","","","","0.694","","","","has coordinates","265876","2021-06-05","17:27:16",""
"7128275","28.4028","0.0006","25.8252","0.0006","6.40719","0.00018","90","","90","","90","","4699.7","0.2","123","","123","","","","","","","","","7","P n n m","-P 2 2n","58","","","","- C21 H14 F3 N4 O3 Rh S -","- C21 H14 F3 N4 O3 Rh S -","- C168 H112 F24 N32 O24 Rh8 S8 -","8","1","","Yatabe, Takeshi; Kamitakahara, Kazuki; Higashijima, Kaede; Ando, Tatsuya; Matsumoto, Takahiro; Yoon, Ki-Seok; Enomoto, Takao; Ogo, Seiji","Synthesis of acetic acid from CO<sub>2</sub>, CH<sub>3</sub>I and H<sub>2</sub> using a water-soluble electron storage catalyst.","Chemical communications (Cambridge, England)","2021","57","39","4772","4774","10.1039/d1cc01611c","","","0.71073","MoKα","","0.0578","0.0487","","","0.1377","0.144","","","","","","1.035","","","","has coordinates,has disorder","265876","2021-06-05","17:27:16",""
"7128276","16.843","0.011","5.48","0.002","15.129","0.006","90","","111.15","0.02","90","","1302.3","1.1","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H14 O3 -","- C17 H14 O3 -","- C68 H56 O12 -","4","1","","Wang, Siqi; Miao, Erfei; Wang, Hao; Song, Bichao; Huang, Wei; Yang, Weibo","Rh-Catalyzed cascade C-H activation/C-C cleavage/cyclization of carboxylic acids with cyclopropanols.","Chemical communications (Cambridge, England)","2021","57","48","5929","5932","10.1039/d1cc01778k","","","0.71073","MoKα","","0.1339","0.0997","","","0.2488","0.2709","","","","","","1.17","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128277","29.694","0.005","10.5922","0.0016","32.967","0.005","90","","90","","90","","10369","3","143.15","","143.15","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","(N,N-bis(2-(diphenylphosphinomethylamido)phenyl)methylamine)-(dimethyl(phenyl)silyl)-(μ-pyridin-2-yl)-aluminium-rhodium","","- C52 H50 Al N4 P2 Rh Si -","- C52 H50 Al N4 P2 Rh Si -","- C416 H400 Al8 N32 P16 Rh8 Si8 -","8","1","","Hara, Naofumi; Uemura, Nao; Nakao, Yoshiaki","C2-Selective silylation of pyridines by a rhodium-aluminum complex.","Chemical communications (Cambridge, England)","2021","57","48","5957","5960","10.1039/d1cc00278c","","x-ray","0.71075","MoKα","","0.0797","0.0611","","","0.1147","0.1239","","","","","","1.094","","","","has coordinates","267036","2021-07-05","16:21:04",""
"7128278","10.528","0.018","11.89","0.03","20.18","0.03","90.03","0.05","97.48","0.05","105.32","0.05","2414","8","143.15","","143.15","","","","","","","","","6","P -1","-P 1","2","","(η2,η2-bicyclo[2.2.1]hepta-2,5-diene)-(N,N-bis(2-(diphenylphosphinomethylamido)phenyl)methylamine)-(4-dimethylaminopyridine)-aluminium-rhodium","","- C53 H53 Al N5 P2 Rh -","- C53 H53 Al N5 P2 Rh -","- C106 H106 Al2 N10 P4 Rh2 -","2","1","","Hara, Naofumi; Uemura, Nao; Nakao, Yoshiaki","C2-Selective silylation of pyridines by a rhodium-aluminum complex.","Chemical communications (Cambridge, England)","2021","57","48","5957","5960","10.1039/d1cc00278c","","x-ray","0.71075","MoKα","","0.0562","0.0464","","","0.0915","0.0969","","","","","","1.073","","","","has coordinates","267036","2021-07-05","16:21:05",""
"7128279","8.0707","0.0001","18.5864","0.0003","11.3791","0.0002","90","","101.789","0.0006","90","","1670.92","0.05","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 Cl N O3 S -","- C18 H16 Cl N O3 S -","- C72 H64 Cl4 N4 O12 S4 -","4","1","","Deng, Yongming; Zhang, Jason; Bankhead, Bradley; Markham, Jonathan P.; Zeller, Matthias","Photoinduced oxidative cyclopropanation of ene-ynamides: synthesis of 3-aza[<i>n</i>.1.0]bicycles <i>via</i> vinyl radicals.","Chemical communications (Cambridge, England)","2021","57","43","5254","5257","10.1039/d1cc02016a","","","1.54178","CuKα","","0.032","0.0307","","","0.0792","0.0801","","","","","","1.043","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128280","10.2711","0.0002","8.2248","0.0002","21.6325","0.0004","90","","95.3585","0.0006","90","","1819.48","0.07","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Cl N O3 S -","- C20 H20 Cl N O3 S -","- C80 H80 Cl4 N4 O12 S4 -","4","1","","Deng, Yongming; Zhang, Jason; Bankhead, Bradley; Markham, Jonathan P.; Zeller, Matthias","Photoinduced oxidative cyclopropanation of ene-ynamides: synthesis of 3-aza[<i>n</i>.1.0]bicycles <i>via</i> vinyl radicals.","Chemical communications (Cambridge, England)","2021","57","43","5254","5257","10.1039/d1cc02016a","","","1.54178","CuKα","","0.0348","0.033","","","0.0827","0.0839","","","","","","1.064","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128281","5.6716","0.0002","13.841","0.0006","22.4239","0.0009","86.8683","0.0017","89.7811","0.0017","89.8515","0.0018","1757.64","0.12","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H18 Cl N O3 S -","- C19 H18 Cl N O3 S -","- C76 H72 Cl4 N4 O12 S4 -","4","2","","Deng, Yongming; Zhang, Jason; Bankhead, Bradley; Markham, Jonathan P.; Zeller, Matthias","Photoinduced oxidative cyclopropanation of ene-ynamides: synthesis of 3-aza[<i>n</i>.1.0]bicycles <i>via</i> vinyl radicals.","Chemical communications (Cambridge, England)","2021","57","43","5254","5257","10.1039/d1cc02016a","","","1.54178","CuKα","","0.0482","0.0425","","","0.0948","0.0978","","","","","","1.135","","","","has coordinates,has disorder","301860","2025-08-22","09:27:03",""
"7128282","10.4364","0.0017","12.3676","0.0018","14.215","0.002","90","","90","","90","","1834.8","0.5","273.15","","273.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","DM-3-84","","- C22 H17 Cl N2 O -","- C22 H17 Cl N2 O -","- C88 H68 Cl4 N8 O4 -","4","1","","Mondal, Debasmita; Pal, Gargi; Chowdhury, Chinmay","Palladium(0)-catalysed regioselective cyclisations of 2-amino(tosyl) benzamides/sulphonamides: the stereoselective synthesis of 3-ylidene-[1,4]benzodiazepin-5-ones/benzo[<i>f</i>][1,2,5]thiadiazepine-1,1-dioxides.","Chemical communications (Cambridge, England)","2021","57","44","5462","5465","10.1039/d1cc00793a","","","1.54178","CuKα","","0.0351","0.0334","","","0.0823","0.085","","","","","","1.034","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128283","8.13","0.003","10.804","0.006","12.33","0.005","82.36","0.02","88.815","0.012","80.34","0.02","1058.2","0.8","273","","273.15","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 N2 O3 S -","- C24 H22 N2 O3 S -","- C48 H44 N4 O6 S2 -","2","1","","Mondal, Debasmita; Pal, Gargi; Chowdhury, Chinmay","Palladium(0)-catalysed regioselective cyclisations of 2-amino(tosyl) benzamides/sulphonamides: the stereoselective synthesis of 3-ylidene-[1,4]benzodiazepin-5-ones/benzo[<i>f</i>][1,2,5]thiadiazepine-1,1-dioxides.","Chemical communications (Cambridge, England)","2021","57","44","5462","5465","10.1039/d1cc00793a","","","0.71073","MoKα","","0.0626","0.0475","","","0.1193","0.1318","","","","","","1.077","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128284","9.4643","0.0006","18.163","0.0012","10.9267","0.0007","90","","113.234","0.002","90","","1725.97","0.19","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H18 N2 O2 S -","- C21 H18 N2 O2 S -","- C84 H72 N8 O8 S4 -","4","1","","Mondal, Debasmita; Pal, Gargi; Chowdhury, Chinmay","Palladium(0)-catalysed regioselective cyclisations of 2-amino(tosyl) benzamides/sulphonamides: the stereoselective synthesis of 3-ylidene-[1,4]benzodiazepin-5-ones/benzo[<i>f</i>][1,2,5]thiadiazepine-1,1-dioxides.","Chemical communications (Cambridge, England)","2021","57","44","5462","5465","10.1039/d1cc00793a","","","1.54178","CuKα","","0.04","0.0396","","","0.1006","0.101","","","","","","1.093","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128285","15.9293","0.0011","8.0486","0.0005","16.3016","0.0011","90","","103.033","0.004","90","","2036.2","0.2","273","","273","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 N2 O4 S2 -","- C22 H20 N2 O4 S2 -","- C88 H80 N8 O16 S8 -","4","1","","Mondal, Debasmita; Pal, Gargi; Chowdhury, Chinmay","Palladium(0)-catalysed regioselective cyclisations of 2-amino(tosyl) benzamides/sulphonamides: the stereoselective synthesis of 3-ylidene-[1,4]benzodiazepin-5-ones/benzo[<i>f</i>][1,2,5]thiadiazepine-1,1-dioxides.","Chemical communications (Cambridge, England)","2021","57","44","5462","5465","10.1039/d1cc00793a","","","1.54184","CuKα","","0.067","0.0667","","","0.1408","0.141","","","","","","1.274","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128286","6.7868","0.0003","24.2929","0.001","6.8686","0.0003","90","","102.298","0.002","90","","1106.45","0.08","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2","2-pentafluorophenylindene","","- C15 H7 F5 -","- C15 H7 F5 -","- C60 H28 F20 -","4","1","","Hasenbeck, Max; Wech, Felix; Averdunk, Arthur; Becker, Jonathan; Gellrich, Urs","Indene formation upon borane-induced cyclization of arylallenes, 1,1-carboboration, and retro-hydroboration.","Chemical communications (Cambridge, England)","2021","57","45","5518","5521","10.1039/d1cc01750k","","","0.71073","MoKα","","0.0563","0.0381","","","0.098","0.1118","","","","","","1.065","","","","has coordinates,has disorder","265898","2021-06-05","17:32:34",""
"7128287","22.0147","0.0002","4.4172","0.0001","31.4419","0.0004","90","","98.588","0.001","90","","3023.23","0.08","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 N2 O2 -","- C18 H18 N2 O2 -","- C144 H144 N16 O16 -","8","2","","Bennett, Ryan M.; Sun, Wei; Wilson, Dharyl C.; Light, Mark E.; Harrowven, David C.","A new mode of cyclobutenedione ring opening for the synthesis of 2-oxobut-3-enamides and tetrasubstituted furans.","Chemical communications (Cambridge, England)","2021","57","46","5694","5697","10.1039/d1cc02097h","","x-ray","1.54184","CuKα","","0.0537","0.0454","","","0.115","0.1211","","","","","","1.03","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128288","14.7511","0.0002","10.2609","0.0001","12.1428","0.0002","90","","95.817","0.001","90","","1828.46","0.04","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H25 Br N2 O3 -","- C18 H25 Br N2 O3 -","- C72 H100 Br4 N8 O12 -","4","1","","Bennett, Ryan M.; Sun, Wei; Wilson, Dharyl C.; Light, Mark E.; Harrowven, David C.","A new mode of cyclobutenedione ring opening for the synthesis of 2-oxobut-3-enamides and tetrasubstituted furans.","Chemical communications (Cambridge, England)","2021","57","46","5694","5697","10.1039/d1cc02097h","","x-ray","0.71073","MoKα","K-L~3~","0.0516","0.038","","","0.0751","0.0801","","","","","","1.056","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128289","6.0189","0.0003","10.6268","0.0006","14.7651","0.0006","70.26","0.004","88.043","0.004","78.758","0.004","871.33","0.08","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H30 N2 O3 -","- C16 H30 N2 O3 -","- C32 H60 N4 O6 -","2","1","","Bennett, Ryan M.; Sun, Wei; Wilson, Dharyl C.; Light, Mark E.; Harrowven, David C.","A new mode of cyclobutenedione ring opening for the synthesis of 2-oxobut-3-enamides and tetrasubstituted furans.","Chemical communications (Cambridge, England)","2021","57","46","5694","5697","10.1039/d1cc02097h","","x-ray","0.71073","MoKα","K-L~3~","0.0634","0.0482","","","0.129","0.1367","","","","","","1.05","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128290","10.6332","0.0003","17.0344","0.0004","13.7271","0.0003","90","","109.336","0.001","90","","2346.14","0.1","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 O4 -","- C30 H26 O4 -","- C120 H104 O16 -","4","1","","Zhou, Liejin; Liu, Lu","Highly enantioselective tandem cycloisomerization/Diels-Alder reaction of 2-(1-alkynyl)-2-alken-1-ones and enals: dual catalysis with platinum and amines.","Chemical communications (Cambridge, England)","2021","57","46","5690","5693","10.1039/d1cc02080c","","","1.54178","CuKα","","0.0397","0.0391","","","0.1081","0.1087","","","","","","1.063","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128291","9.5167","0.0014","11.0235","0.0017","13.535","0.002","94.069","0.011","97.179","0.01","99.905","0.011","1381.6","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H22 Cl N O -","- C33 H22 Cl N O -","- C66 H44 Cl2 N2 O2 -","2","1","","Kundu, Samrat; Banerjee, Ankush; Pal, Shyam Chand; Ghosh, Meghna; Maji, Modhu Sudan","Cascade annulative π-extension for the rapid construction of carbazole based polyaromatic hydrocarbons.","Chemical communications (Cambridge, England)","2021","57","47","5762","5765","10.1039/d1cc00668a","","","0.71073","MoKα","","0.2816","0.0845","","","0.1889","0.2585","","","","","","0.741","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128292","10.249","0.004","10.824","0.006","11.279","0.004","80.26","0.013","67.268","0.013","85.1","0.02","1137.1","0.9","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H23 N O -","- C34 H23 N O -","- C68 H46 N2 O2 -","2","1","","Kundu, Samrat; Banerjee, Ankush; Pal, Shyam Chand; Ghosh, Meghna; Maji, Modhu Sudan","Cascade annulative π-extension for the rapid construction of carbazole based polyaromatic hydrocarbons.","Chemical communications (Cambridge, England)","2021","57","47","5762","5765","10.1039/d1cc00668a","","","0.71073","MoKα","","0.1253","0.0613","","","0.1497","0.2084","","","","","","1.054","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128293","16.09","0.03","5.262","0.013","23.54","0.05","90","","96.07","0.02","90","","1982","7","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C33 H19 N -","- C33 H19 N -","- C132 H76 N4 -","4","1","","Kundu, Samrat; Banerjee, Ankush; Pal, Shyam Chand; Ghosh, Meghna; Maji, Modhu Sudan","Cascade annulative π-extension for the rapid construction of carbazole based polyaromatic hydrocarbons.","Chemical communications (Cambridge, England)","2021","57","47","5762","5765","10.1039/d1cc00668a","","","0.71073","MoKα","","0.1462","0.0624","","","0.151","0.1961","","","","","","1.029","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128294","29.4033","0.0013","34.6034","0.0015","9.5921","0.0005","90","","90","","90","","9759.5","0.8","298","2","298","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C34 H25 N O -","- C34 H25 N O -","- C544 H400 N16 O16 -","16","1","","Kundu, Samrat; Banerjee, Ankush; Pal, Shyam Chand; Ghosh, Meghna; Maji, Modhu Sudan","Cascade annulative π-extension for the rapid construction of carbazole based polyaromatic hydrocarbons.","Chemical communications (Cambridge, England)","2021","57","47","5762","5765","10.1039/d1cc00668a","","","0.71073","MoKα","","0.1599","0.0686","","","0.1718","0.2219","","","","","","0.972","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128295","16.6969","0.0008","10.4621","0.0005","18.3","0.0008","90","","99.112","0.002","90","","3156.4","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H44 P2 Ti -","- C37 H44 P2 Ti -","- C148 H176 P8 Ti4 -","4","1","","Fischer, Malte; Reiß, Fabian; Hering-Junghans, Christian","Titanocene pnictinidene complexes.","Chemical communications (Cambridge, England)","2021","57","46","5626","5629","10.1039/d1cc01305j","","","1.54178","CuKα","","0.0321","0.0311","","","0.0854","0.087","","","","","","1.057","","","","has coordinates","267019","2021-07-05","16:16:54",""
"7128296","17.7808","0.0005","19.3646","0.0005","21.7658","0.0005","79.424","0.002","81.436","0.002","89.781","0.002","7282.8","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H74.67 As P Ti -","- C43 H56 As P Ti -","- C258 H336 As6 P6 Ti6 -","6","3","","Fischer, Malte; Reiß, Fabian; Hering-Junghans, Christian","Titanocene pnictinidene complexes.","Chemical communications (Cambridge, England)","2021","57","46","5626","5629","10.1039/d1cc01305j","","","1.54178","CuKα","","0.0711","0.0505","","","0.1275","0.1423","","","","","","1.025","","","","has coordinates,has disorder","267019","2021-07-05","16:16:54",""
"7128297","13.2848","0.001","14.6046","0.0012","16.1967","0.0013","97.9377","0.0029","97.4838","0.0028","96.5107","0.0029","3058.1","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C72 H86 As2 P0 -","- C72 H86 As2 -","- C144 H172 As4 -","2","1","","Fischer, Malte; Reiß, Fabian; Hering-Junghans, Christian","Titanocene pnictinidene complexes.","Chemical communications (Cambridge, England)","2021","57","46","5626","5629","10.1039/d1cc01305j","","","0.71073","MoKα","","0.037","0.0297","","","0.0761","0.08","","","","","","1.036","","","","has coordinates,has disorder","267019","2021-07-05","16:16:54",""
"7128298","21.4486","0.0015","14.9005","0.001","16.023","0.0011","90","","95.227","0.0013","90","","5099.6","0.6","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C60 H74 As2 -","- C60 H74 As2 -","- C240 H296 As8 -","4","0.5","","Fischer, Malte; Reiß, Fabian; Hering-Junghans, Christian","Titanocene pnictinidene complexes.","Chemical communications (Cambridge, England)","2021","57","46","5626","5629","10.1039/d1cc01305j","","","0.71073","MoKα","","0.0479","0.0315","","","0.0758","0.0836","","","","","","1.024","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128299","17.1874","0.0005","7.5058","0.0003","37.0743","0.0018","90","","90","","90","","4782.8","0.3","100","0.1","100","0.1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C36 H23 N O2 -","- C36 H23 N O2 -","- C288 H184 N8 O16 -","8","1","","Wang, Yali; Jiang, Haiyan; Liu, Xueling; Xu, Jun; Gao, Yan; Finney, Nathaniel S.","A palate of fluorescent corannulene derivatives: synthesis, spectroscopic properties, and bio-imaging application.","Chemical communications (Cambridge, England)","2021","57","47","5818","5821","10.1039/d1cc02307a","","x-ray","1.54184","CuKα","","0.077","0.0573","","","0.1464","0.1606","","","","","","1.049","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128300","9.1567","0.0001","7.7528","0.0001","34.6394","0.0003","90","","91.116","0.001","90","","2458.59","0.05","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H25 B F2 N2 -","- C34 H25 B F2 N2 -","- C136 H100 B4 F8 N8 -","4","1","","Wang, Yali; Jiang, Haiyan; Liu, Xueling; Xu, Jun; Gao, Yan; Finney, Nathaniel S.","A palate of fluorescent corannulene derivatives: synthesis, spectroscopic properties, and bio-imaging application.","Chemical communications (Cambridge, England)","2021","57","47","5818","5821","10.1039/d1cc02307a","","x-ray","1.54184","CuKα","","0.0443","0.0414","","","0.1074","0.1096","","","","","","1.039","","","","has coordinates","267031","2021-07-05","16:20:01",""
"7128301","7.7592","0.0002","11.1022","0.0003","14.1866","0.0004","90","","90","","90","","1222.09","0.06","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C1.5 H4.5 I1.5 O0.5 Pb0.5 S0.5 -","- C1.5 H4.5 I1.5 O0.5 Pb0.5 S0.5 -","- C12 H36 I12 O4 Pb4 S4 -","8","1","","Tanaka, Yuki; Bai, Shiqiang; Wang, Xizu; Tee, Si Yin; Lim, Siew Lay; Ke, Lin; Dolmanan, Surani B.; Lee, Coryl Jing Jun; Lim, Poh Chong; Yao, Xiang; Wu, Jishan; Han, Ming-Yong","Synthesis and optical and electronic properties of one-dimensional sulfoxonium-based hybrid metal halide (CH<sub>3</sub>)<sub>3</sub>SOPbI<sub>3</sub>.","Chemical communications (Cambridge, England)","2021","57","47","5790","5793","10.1039/d1cc01386f","","","0.71073","MoKα","","0.026","0.0225","","","0.0458","0.0471","","","","","","1.155","","","","has coordinates","267028","2021-07-05","16:19:24",""
"7128302","13.5937","0.0009","17.9179","0.0012","11.5204","0.0007","90","","100.389","0.006","90","","2760","0.3","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C54 H48 N6 O10 -","- C54 H46 N6 O10 -","- C108 H92 N12 O20 -","2","0.25","","Luo, Yang-Hui; Zhang, Lan; Fang, Wen-Xia; Ma, Shu-Hua; Dong, Hui; Su, Shan; Zheng, Zi-Yue; Li, Di-Ning; Zhai, Li-Hai","2D hydrogen-bonded organic frameworks: in-site generation and subsequent exfoliation.","Chemical communications (Cambridge, England)","2021","57","48","5901","5904","10.1039/d1cc01626a","","","1.54184","CuKα","","0.1647","0.1565","","","0.4304","0.4569","","","","","","2.212","","","","has coordinates","267037","2021-07-05","16:21:12",""
"7128303","13.3968","0.0004","18.0672","0.0004","11.3731","0.0003","90","","100.927","0.003","90","","2702.87","0.13","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C54 H52 N6 O12 -","- C54 H52 N6 O12 -","- C108 H104 N12 O24 -","2","0.25","","Luo, Yang-Hui; Zhang, Lan; Fang, Wen-Xia; Ma, Shu-Hua; Dong, Hui; Su, Shan; Zheng, Zi-Yue; Li, Di-Ning; Zhai, Li-Hai","2D hydrogen-bonded organic frameworks: in-site generation and subsequent exfoliation.","Chemical communications (Cambridge, England)","2021","57","48","5901","5904","10.1039/d1cc01626a","","","1.54178","CuKα","","0.1744","0.1695","","","0.4806","0.496","","","","","","2.495","","","","has coordinates","267037","2021-07-05","16:21:13",""
"7128304","11.134","0.003","13.954","0.003","15.979","0.004","84.307","0.007","74.689","0.006","79.427","0.007","2350.4","1","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C H Cd N O S -","- C5.52381 H4.09524 Cd0.0952381 N0.285714 O0.666667 S0.0952381 -","- C116 H86 Cd2 N6 O14 S2 -","21","10.5","","Mir, Mohammad Hedayetullah; Bera, Sambhunath; Khan, Samim; Maity, Suvendu; Sinha, Chittaranjan; Dutta, Basudeb","Sunlight assisted SCSC dimerization of a 1D coordination polymer impacts the selectivity of Pd(II) sensing in water.","Chemical communications (Cambridge, England)","2021","57","50","6197","6200","10.1039/d1cc02121d","","","0.71073","MoKα","","0.1338","0.1249","","","0.361","0.3767","","","","","","2.599","","","","has coordinates","267026","2021-07-05","16:19:07",""
"7128305","11.0879","0.0019","13.986","0.002","15.953","0.003","83.286","0.005","73.056","0.005","79.719","0.005","2323","0.7","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H46 Cd N3 O7 S -","- C58 H46 Cd N3 O7 S -","- C116 H92 Cd2 N6 O14 S2 -","2","1","","Mir, Mohammad Hedayetullah; Bera, Sambhunath; Khan, Samim; Maity, Suvendu; Sinha, Chittaranjan; Dutta, Basudeb","Sunlight assisted SCSC dimerization of a 1D coordination polymer impacts the selectivity of Pd(II) sensing in water.","Chemical communications (Cambridge, England)","2021","57","50","6197","6200","10.1039/d1cc02121d","","","0.71073","MoKα","","0.0982","0.0821","","","0.21","0.2367","","","","","","1.036","","","","has coordinates","267026","2021-07-05","16:19:08",""
"7128306","21.9888","0.0009","17.1848","0.0006","10.7513","0.0004","90","","117.164","0.003","90","","3614.5","0.3","100","","100","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C74 H106 Al6 As4 -","- C67 H98 Al6 As4 -","- C134 H196 Al12 As8 -","2","0.25","","Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W.","Reactivity of mono- and divalent aluminium compounds towards group 15 nanoparticles.","Chemical communications (Cambridge, England)","2021","57","45","5503","5506","10.1039/d1cc01475g","","x-ray","0.71073","MoKα","","0.0524","0.0386","","","0.0988","0.1063","","","","","","1.024","","","","has coordinates,has disorder","265900","2021-06-05","17:32:54",""
"7128307","18.8354","0.001","18.8354","0.001","8.3709","0.0006","90","","90","","120","","2571.9","0.3","150","","150","","","","","","","","","5","R 3 :H","R 3","146","","","","- C30 H45 Al3 As I3 -","- C30 H45 Al3 As I3 -","- C90 H135 Al9 As3 I9 -","3","0.333333","","Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W.","Reactivity of mono- and divalent aluminium compounds towards group 15 nanoparticles.","Chemical communications (Cambridge, England)","2021","57","45","5503","5506","10.1039/d1cc01475g","","x-ray","0.71073","MoKα","","0.0231","0.0209","","","0.0473","0.0476","","","","","","1.069","","","","has coordinates","265900","2021-06-05","17:32:54",""
"7128308","11.3402","0.0004","16.7244","0.0007","18.6143","0.0008","95.614","0.003","90.722","0.003","108.785","0.003","3322.6","0.2","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H45 Al3 As Br3 -","- C30 H45 Al3 As Br3 -","- C120 H180 Al12 As4 Br12 -","4","2","","Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W.","Reactivity of mono- and divalent aluminium compounds towards group 15 nanoparticles.","Chemical communications (Cambridge, England)","2021","57","45","5503","5506","10.1039/d1cc01475g","","x-ray","0.71073","MoKα","","0.0791","0.0476","","","0.1123","0.1291","","","","","","1.015","","","","has coordinates","265900","2021-06-05","17:32:54",""
"7128309","31.0554","0.001","17.2141","0.0004","13.6117","0.0003","90","","90","","90","","7276.7","0.3","100","","100","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C72 H102 Al7 As5 -","- C72 H102 Al7 As5 -","- C288 H408 Al28 As20 -","4","0.5","","Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W.","Reactivity of mono- and divalent aluminium compounds towards group 15 nanoparticles.","Chemical communications (Cambridge, England)","2021","57","45","5503","5506","10.1039/d1cc01475g","","x-ray","0.71073","MoKα","","0.0556","0.0337","","","0.0652","0.0722","","","","","","1.023","","","","has coordinates,has disorder","265900","2021-06-05","17:32:54",""
"7128310","9.4482","0.0004","12.6347","0.0004","5.7085","0.0002","90","","110.407","0.003","90","","638.68","0.04","100","2","100","","","","","","","","","5","P 1 21 1","P 2yb","4","Triglycine sulfate","","","- C6 H17 N3 O10 S -","- C6 H17 N3 O10 S -","- C12 H34 N6 O20 S2 -","2","1","","Kawasaki, Tsuneomi; Kaimori, Yoshiyasu; Shimada, Seiya; Hara, Natsuki; Sato, Susumu; Suzuki, Kenta; Asahi, Toru; Matsumoto, Arimasa; Soai, Kenso","Asymmetric autocatalysis triggered by triglycine sulfate with switchable chirality by altering the direction of the applied electric field.","Chemical communications (Cambridge, England)","2021","57","49","5999","6002","10.1039/d1cc02162a","","","0.71073","MoKα","","0.026","0.0243","","","0.0647","0.0656","","","","","","1.055","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128311","9.4396","0.0004","12.6268","0.0004","5.6979","0.0002","90","","110.395","0.003","90","","636.57","0.04","100","","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","Triglycine sulfate","","","- C6 H17 N3 O10 S -","- C6 H17 N3 O10 S -","- C12 H34 N6 O20 S2 -","2","1","","Kawasaki, Tsuneomi; Kaimori, Yoshiyasu; Shimada, Seiya; Hara, Natsuki; Sato, Susumu; Suzuki, Kenta; Asahi, Toru; Matsumoto, Arimasa; Soai, Kenso","Asymmetric autocatalysis triggered by triglycine sulfate with switchable chirality by altering the direction of the applied electric field.","Chemical communications (Cambridge, England)","2021","57","49","5999","6002","10.1039/d1cc02162a","","","0.71073","MoKα","","0.0319","0.0295","","","0.0751","0.077","","","","","","1.052","","","","has coordinates","301860","2025-08-22","09:27:03",""
"7128312","13.6224","0.0009","16.1549","0.001","22.493","0.0016","90","","105.752","0.003","90","","4764.1","0.6","140","2","140","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C42 H48.97 B Cl Co Fe N13 O8 -","- C42 H48.96 B Cl Co Fe N13 O8 -","- C168 H195.84 B4 Cl4 Co4 Fe4 N52 O32 -","4","1","","Yadav, Jyoti; Mondal, Dibya Jyoti; Konar, Sanjit","High-temperature electron transfer coupled spin transition (ETCST) with hysteresis in a discrete [Fe<sub>2</sub>Co<sub>2</sub>] Prussian blue analogue.","Chemical communications (Cambridge, England)","2021","57","48","5925","5928","10.1039/d1cc01160j","","","0.71073","MoKα","","0.1005","0.0546","","","0.0866","0.0993","","","","","","1.053","","","","has coordinates,has disorder","267033","2021-07-05","16:20:30",""
"7128313","23.1444","0.0016","18.7701","0.0009","17.1873","0.0008","90","","110.277","0.002","90","","7003.8","0.7","150","2","150","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C64.33 H73.45 B2 Cl2.48 F6 Fe N4 O5.4 P3 -","- C64.328 H73.45 B2 Cl2.48 F6 Fe N4 O5.397 P3 -","- C257.312 H293.8 B8 Cl9.92 F24 Fe4 N16 O21.588 P12 -","4","1","","Taher, Deeb; Wilson, Jessica R.; Ritch, Grayson; Zeller, Matthias; Szymczak, Nathaniel K.","Late-stage ligand functionalization <i>via</i> the Staudinger reaction using phosphine-appended 2,2'-bipyridine.","Chemical communications (Cambridge, England)","2021","57","46","5718","5721","10.1039/d1cc01407b","","","0.71073","MoKα","","0.1219","0.0672","","","0.1751","0.2202","","","","","","1.019","","","","has coordinates,has disorder","267020","2021-07-05","16:17:12",""
"7128314","19.7052","0.0003","7.9644","0.0001","22.605","0.0003","90","","100.994","0.001","90","","3482.52","0.08","85","2","85","2","","","","","","","","7","I 1 2 1","I 2y","5","","","","- C38 H34 Cl2 Fe N2 O P2 -","- C38 H34 Cl2 Fe N2 O P2 -","- C152 H136 Cl8 Fe4 N8 O4 P8 -","4","1","","Taher, Deeb; Wilson, Jessica R.; Ritch, Grayson; Zeller, Matthias; Szymczak, Nathaniel K.","Late-stage ligand functionalization <i>via</i> the Staudinger reaction using phosphine-appended 2,2'-bipyridine.","Chemical communications (Cambridge, England)","2021","57","46","5718","5721","10.1039/d1cc01407b","","","1.54178","CuKα","","0.0307","0.0302","","","0.0807","0.0814","","","","","","1.032","","","","has coordinates","267020","2021-07-05","16:17:15",""
"7128315","15.2634","0.0003","20.6508","0.0004","24.3094","0.0003","85.532","0.001","81.354","0.001","82.679","0.002","7500","0.2","85","2","85","2","","","","","","","","9","P -1","-P 1","2","","","","- C157.51 H154.77 Br0.87 Cl2.13 F18 Fe3 N13 O4.38 P9 -","- C157.508 H154.77 Br0.875 Cl2.125 F18 Fe3 N13 O4.377 P9 -","- C315.016 H309.54 Br1.75 Cl4.25 F36 Fe6 N26 O8.754 P18 -","2","1","","Taher, Deeb; Wilson, Jessica R.; Ritch, Grayson; Zeller, Matthias; Szymczak, Nathaniel K.","Late-stage ligand functionalization <i>via</i> the Staudinger reaction using phosphine-appended 2,2'-bipyridine.","Chemical communications (Cambridge, England)","2021","57","46","5718","5721","10.1039/d1cc01407b","","","1.54178","CuKα","","0.0742","0.061","","","0.1543","0.1673","","","","","","1.022","","","","has coordinates,has disorder","267020","2021-07-05","16:17:15",""
"7128316","19.7512","0.0002","18.6528","0.0001","17.5182","0.0002","90","","114.124","0.001","90","","5890.3","0.11","85","2","85","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C60.45 H66.79 Cl F6 Fe N4.67 O1.28 P3 -","- C60.448 H66.788 Cl F6 Fe N4.666 O1.279 P3 -","- C241.792 H267.152 Cl4 F24 Fe4 N18.664 O5.116 P12 -","4","1","","Taher, Deeb; Wilson, Jessica R.; Ritch, Grayson; Zeller, Matthias; Szymczak, Nathaniel K.","Late-stage ligand functionalization <i>via</i> the Staudinger reaction using phosphine-appended 2,2'-bipyridine.","Chemical communications (Cambridge, England)","2021","57","46","5718","5721","10.1039/d1cc01407b","","","1.54178","CuKα","","0.0424","0.041","","","0.1107","0.1121","","","","","","1.062","","","","has coordinates,has disorder","267020","2021-07-05","16:17:15",""
"7128317","18.042","0.0002","18.7721","0.0002","17.1927","0.0002","90","","112.116","0.001","90","","5394.5","0.11","85","2","85","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C54.09 H47.75 Cl F12 Fe N4.73 O1.16 P3 -","- C54.088 H47.752 Cl F12 Fe N4.734 O1.155 P3 -","- C216.352 H191.008 Cl4 F48 Fe4 N18.936 O4.62 P12 -","4","1","","Taher, Deeb; Wilson, Jessica R.; Ritch, Grayson; Zeller, Matthias; Szymczak, Nathaniel K.","Late-stage ligand functionalization <i>via</i> the Staudinger reaction using phosphine-appended 2,2'-bipyridine.","Chemical communications (Cambridge, England)","2021","57","46","5718","5721","10.1039/d1cc01407b","","","1.54178","CuKα","","0.0491","0.0441","","","0.1184","0.1242","","","","","","1.062","","","","has coordinates,has disorder","267020","2021-07-05","16:17:15",""
"7128318","18.7088","0.0007","16.0003","0.0007","26.2937","0.0012","90","","95.453","0.004","90","","7835.3","0.6","173","0.1","173","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C164 H144 Au8 N2 P8 -","- C164 H144 Au8 N2 P8 -","- C328 H288 Au16 N4 P16 -","2","0.5","","Yang, Biao; Wu, Han; Zhao, Liang","Photoluminescence enhancement by controllable aggregation and polymerization of octanuclear gold clusters.","Chemical communications (Cambridge, England)","2021","57","47","5770","5773","10.1039/d1cc01162f","","x-ray","1.54184","CuKα","","0.2187","0.1457","","","0.2994","0.3487","","","","","","1.064","","","","has coordinates","267029","2021-07-05","16:19:36",""
"7128319","17.5317","0.0003","19.3738","0.0003","20.9396","0.0003","88.829","0.001","71.633","0.001","70.71","0.001","6343.14","0.18","172.99","0.1","172.99","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C124 H116 Au8 N2 P8 -","- C124 H116 Au8 N2 P8 -","- C248 H232 Au16 N4 P16 -","2","1","","Yang, Biao; Wu, Han; Zhao, Liang","Photoluminescence enhancement by controllable aggregation and polymerization of octanuclear gold clusters.","Chemical communications (Cambridge, England)","2021","57","47","5770","5773","10.1039/d1cc01162f","","x-ray","1.54184","CuKα","","0.0908","0.0795","","","0.2134","0.2265","","","","","","1.021","","","","has coordinates","267029","2021-07-05","16:19:36",""
"7128320","37.3667","0.0005","37.3667","0.0005","4.75497","0.00013","90","","90","","90","","6639.2","0.2","293","2","293","2","","","","","","","","7","I 41","I 4bw","80","","","","- C20 H32 Cl Cu N4 O6 S2 -","- C20 H32 Cl Cu N4 O6 S2 -","- C160 H256 Cl8 Cu8 N32 O48 S16 -","8","1","","Luo, Bi; Chen, Liguang; Hong, Zhaoguo; You, Xin; Huang, Fu-Ping; Bian, He-Dong; Zhang, Liangliang; Zhao, Shulin","A simple and feasible atom-precise biotinylated Cu(i) complex for tumor-targeted chemodynamic therapy.","Chemical communications (Cambridge, England)","2021","57","49","6046","6049","10.1039/d1cc00515d","","x-ray","0.71073","MoKα","","0.097","0.0706","","","0.1961","0.222","","","","","","1.064","","","","has coordinates,has disorder","267041","2021-07-05","16:22:45",""
"7128321","21.2553","0.0016","21.2553","0.0016","21.2553","0.0016","90","","90","","90","","9602.9","1.3","253","2","253","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","catena-[bis(m-hydroxo)-bis(m-oxo)-tris(m-terephthalato)-tri-Thulium]","","- C24 H12 O16 Tm3 -","- C24 H12 O16 Tm3 -","- C192 H96 O128 Tm24 -","8","0.0416667","","Donnarumma, P. Rafael; Frojmovic, Sahara; Marino, Paola; Bicalho, Hudson A.; Titi, Hatem M.; Howarth, Ashlee J.","Synthetic approaches for accessing rare-earth analogues of UiO-66.","Chemical communications (Cambridge, England)","2021","57","50","6121","6124","10.1039/d1cc01552d","","","1.54178","CuKα","","0.0433","0.0369","","","0.095","0.1065","","","","","","1.091","","","","has coordinates","267027","2021-07-05","16:19:18",""
"7128322","33.177","0.0009","10.4724","0.0003","22.8239","0.0006","90","","100.412","0.003","90","","7799.4","0.4","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H60 B10 N4 O2.5 P Si -","- C29 H60 B10 N4 O2.5 P Si -","- C232 H480 B80 N32 O20 P8 Si8 -","8","2","","Xiong, Yun; Yao, Shenglai; Ruzicka, Ales; Driess, Matthias","Distinctly different reactivity of bis(silylenyl)-<i>versus</i> phosphanyl-silylenyl-substituted <i>o</i>-dicarborane towards O<sub>2</sub>, N<sub>2</sub>O and CO<sub>2</sub>.","Chemical communications (Cambridge, England)","2021","57","48","5965","5968","10.1039/d1cc01939b","","","1.54184","CuKα","","0.1325","0.0668","","","0.1418","0.1823","","","","","","1.027","","","","has coordinates","267035","2021-07-05","16:20:54",""
"7128323","19.7759","0.0005","9.9587","0.0002","37.0968","0.0011","90","","98.741","0.002","90","","7221.1","0.3","150","2","150","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C27 H55 B10 N4 O P Si -","- C27 H55 B10 N4 O P Si -","- C216 H440 B80 N32 O8 P8 Si8 -","8","1","","Xiong, Yun; Yao, Shenglai; Ruzicka, Ales; Driess, Matthias","Distinctly different reactivity of bis(silylenyl)-<i>versus</i> phosphanyl-silylenyl-substituted <i>o</i>-dicarborane towards O<sub>2</sub>, N<sub>2</sub>O and CO<sub>2</sub>.","Chemical communications (Cambridge, England)","2021","57","48","5965","5968","10.1039/d1cc01939b","","","1.54184","CuKα","","0.062","0.0448","","","0.1135","0.1277","","","","","","1.02","","","","has coordinates","267035","2021-07-05","16:20:54",""
"7128324","16.6462","0.0007","15.4729","0.0005","16.1445","0.0007","90","","117.67","0.006","90","","3682.7","0.3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H55 B10 N4 O3 P Si -","- C28 H55 B10 N4 O3 P Si -","- C112 H220 B40 N16 O12 P4 Si4 -","4","1","","Xiong, Yun; Yao, Shenglai; Ruzicka, Ales; Driess, Matthias","Distinctly different reactivity of bis(silylenyl)-<i>versus</i> phosphanyl-silylenyl-substituted <i>o</i>-dicarborane towards O<sub>2</sub>, N<sub>2</sub>O and CO<sub>2</sub>.","Chemical communications (Cambridge, England)","2021","57","48","5965","5968","10.1039/d1cc01939b","","","1.54184","CuKα","","0.0746","0.0523","","","0.1333","0.1546","","","","","","1.027","","","","has coordinates,has disorder","267035","2021-07-05","16:20:54",""
"7128325","15.43","0.0002","20.2433","0.0002","14.5257","0.0002","90","","96.073","0.001","90","","4511.7","0.1","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C39 H64 B10 N4 O2 Si2 -","- C39 H64 B10 N4 O2 Si2 -","- C156 H256 B40 N16 O8 Si8 -","4","0.5","","Xiong, Yun; Yao, Shenglai; Ruzicka, Ales; Driess, Matthias","Distinctly different reactivity of bis(silylenyl)-<i>versus</i> phosphanyl-silylenyl-substituted <i>o</i>-dicarborane towards O<sub>2</sub>, N<sub>2</sub>O and CO<sub>2</sub>.","Chemical communications (Cambridge, England)","2021","57","48","5965","5968","10.1039/d1cc01939b","","","1.54184","CuKα","","0.0466","0.0447","","","0.1232","0.1257","","","","","","1.052","","","","has coordinates,has disorder","267035","2021-07-05","16:20:54",""
"7128326","9.7706","0.0002","22.3265","0.0004","17.6158","0.0004","90","","103.718","0.002","90","","3733.15","0.14","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H55 B10 N4 O3 P Si -","- C28 H55 B10 N4 O3 P Si -","- C112 H220 B40 N16 O12 P4 Si4 -","4","1","","Xiong, Yun; Yao, Shenglai; Ruzicka, Ales; Driess, Matthias","Distinctly different reactivity of bis(silylenyl)-<i>versus</i> phosphanyl-silylenyl-substituted <i>o</i>-dicarborane towards O<sub>2</sub>, N<sub>2</sub>O and CO<sub>2</sub>.","Chemical communications (Cambridge, England)","2021","57","48","5965","5968","10.1039/d1cc01939b","","","1.54184","CuKα","","0.0601","0.0423","","","0.1013","0.1147","","","","","","1.023","","","","has coordinates","267035","2021-07-05","16:20:54",""
"7128327","7.89131","0.00005","11.97867","0.00007","16.9967","0.00009","90","","90","","90","","1606.65","0.016","100.01","0.1","100.01","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(2?-methylphenyl)-2,3,4-tri-O-methyl-α-L-rhamnopyranoside","","- C16 H24 O5 -","- C16 H24 O5 -","- C64 H96 O20 -","4","1","","Jones, Caleb A. H.; Schley, Nathan D.","Selective demethylation of <i>O</i>-aryl glycosides by iridium-catalyzed hydrosilylation.","Chemical communications (Cambridge, England)","2021","57","48","5953","5956","10.1039/d1cc00496d","","x-ray","1.54184","CuKα","","0.0253","0.0249","","","0.0647","0.0651","","","","","","1.056","","","","has coordinates","267032","2021-07-05","16:20:17",""
"7128328","8.2374","0.0002","12.4665","0.0002","13.7074","0.0003","64.328","0.002","88.439","0.002","86.714","0.002","1266.59","0.05","99.97","0.1","99.97","0.1","","","","","","","","4","P 1","P 1","1","","(2?,4?-dichlorophenyl)-2,3,4-tri-O-methyl-α-L-rhamnopyranoside","","- C15 H20 Cl2 O5 -","- C15 H20 Cl2 O5 -","- C45 H60 Cl6 O15 -","3","3","","Jones, Caleb A. H.; Schley, Nathan D.","Selective demethylation of <i>O</i>-aryl glycosides by iridium-catalyzed hydrosilylation.","Chemical communications (Cambridge, England)","2021","57","48","5953","5956","10.1039/d1cc00496d","","x-ray","1.54184","CuKα","","0.022","0.0218","","","0.0573","0.0574","","","","","","1.021","","","","has coordinates","267032","2021-07-05","16:20:18",""
"7128329","7.7564","0.0002","13.7188","0.0004","25.4041","0.0008","90","","97.463","0.003","90","","2680.31","0.14","100","0.1","100","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","(2?-methylphenyl)-6-O-triisopropylsilyl-2,3,4-tri-O-methyl-α-D-mannopyranoside","","- C25 H44 O6 Si -","- C25 H44 O6 Si -","- C100 H176 O24 Si4 -","4","2","","Jones, Caleb A. H.; Schley, Nathan D.","Selective demethylation of <i>O</i>-aryl glycosides by iridium-catalyzed hydrosilylation.","Chemical communications (Cambridge, England)","2021","57","48","5953","5956","10.1039/d1cc00496d","","x-ray","1.54184","CuKα","","0.0555","0.0531","","","0.1505","0.1523","","","","","","1.126","","","","has coordinates","267032","2021-07-05","16:20:18",""
"7128330","10.18301","0.0001","13.55501","0.00011","13.69931","0.00014","90","","90","","90","","1890.93","0.03","100","0.1","100","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(2?-t-butylphenyl)-α-L-rhamnopyranoside","","- C19 H28 O6 -","- C19 H28 O6 -","- C76 H112 O24 -","4","1","","Jones, Caleb A. H.; Schley, Nathan D.","Selective demethylation of <i>O</i>-aryl glycosides by iridium-catalyzed hydrosilylation.","Chemical communications (Cambridge, England)","2021","57","48","5953","5956","10.1039/d1cc00496d","","x-ray","1.54184","CuKα","","0.0284","0.0271","","","0.0666","0.0679","","","","","","1.05","","","","has coordinates","267032","2021-07-05","16:20:18",""
"7128331","7.71828","0.00006","13.89043","0.0001","17.59797","0.00013","90","","90","","90","","1886.68","0.02","100","0.1","100","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(2?-t-butylphenyl)-2,3,4-tri-O-methyl-α-L-rhamnopyranoside","","- C19 H30 O5 -","- C19 H30 O5 -","- C76 H120 O20 -","4","1","","Jones, Caleb A. H.; Schley, Nathan D.","Selective demethylation of <i>O</i>-aryl glycosides by iridium-catalyzed hydrosilylation.","Chemical communications (Cambridge, England)","2021","57","48","5953","5956","10.1039/d1cc00496d","","x-ray","1.54184","CuKα","","0.029","0.0279","","","0.0701","0.0708","","","","","","1.036","","","","has coordinates","267032","2021-07-05","16:20:18",""
"7128332","7.72846","0.00011","13.3986","0.0002","17.3987","0.0003","90","","90","","90","","1801.64","0.05","100","1","100","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","S-5 (2?-isopropylphenyl)-2,3,4-tri-O-methyl-α-L-rhamnopyranoside","","- C18 H28 O5 -","- C18 H28 O5 -","- C72 H112 O20 -","4","1","","Jones, Caleb A. H.; Schley, Nathan D.","Selective demethylation of <i>O</i>-aryl glycosides by iridium-catalyzed hydrosilylation.","Chemical communications (Cambridge, England)","2021","57","48","5953","5956","10.1039/d1cc00496d","","x-ray","1.54184","CuKα","","0.0422","0.0409","","","0.1013","0.1025","","","","","","1.037","","","","has coordinates,has disorder","267032","2021-07-05","16:20:18",""
"7128333","23.99","0.02","38.69","0.04","5.573","0.006","90","","90","","90","","5173","9","150","2","150","2","","","","","","","","3","F d d 2","F 2 -2d","43","","","","- C16 H15 N3 -","- C16 H15 N3 -","- C256 H240 N48 -","16","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.1527","0.071","","","0.1542","0.1794","","","","","","1.047","","","","has coordinates,has disorder","267021","2021-07-05","16:18:05",""
"7128334","9.464","0.003","7.518","0.002","12.116","0.003","90","","92.972","0.013","90","","860.9","0.4","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H23 N3 -","- C20 H23 N3 -","- C40 H46 N6 -","2","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.0541","0.0369","","","0.0785","0.0822","","","","","","0.967","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128335","11.0959","0.0005","15.0897","0.0007","16.0556","0.0006","90","","90","","90","","2688.3","0.2","149","2","149","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H14 F N3 -","- C16 H14 F N3 -","- C128 H112 F8 N24 -","8","2","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.0425","0.0335","","","0.0777","0.0805","","","","","","1.033","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128336","8.704","0.003","15.441","0.005","12.626","0.004","90","","91.212","0.017","90","","1696.5","1","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 N5 -","- C19 H19 N5 -","- C76 H76 N20 -","4","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.104","0.0574","","","0.131","0.1509","","","","","","1.038","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128337","11.11","0.007","12.493","0.009","14.899","0.012","75.149","0.018","73.5","0.02","87.94","0.04","1915","2","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H23 N3 -","- C24 H23 N3 -","- C96 H92 N12 -","4","2","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.2094","0.0704","","","0.1076","0.1326","","","","","","0.895","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128338","8.327","0.007","14.46","0.01","29.68","0.02","90","","93.26","0.03","90","","3568","5","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H25 N3 O -","- C21 H25 N3 O -","- C168 H200 N24 O8 -","8","2","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.1933","0.1096","","","0.2428","0.2983","","","","","","1.152","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128339","12.944","0.004","9.04","0.004","14.465","0.005","90","","100.393","0.012","90","","1664.8","1.1","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H23 N3 -","- C20 H23 N3 -","- C80 H92 N12 -","4","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.0729","0.0462","","","0.1348","0.1448","","","","","","1.1","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128340","22.126","0.007","22.131","0.006","17.067","0.005","90","","91.565","0.013","90","","8354","4","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C25 H25 N3 -","- C25 H25 N3 -","- C400 H400 N48 -","16","2","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.1502","0.084","","","0.2117","0.2441","","","","","","1.054","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128341","6.907","0.003","10.401","0.004","12.709","0.004","102.837","0.012","102.334","0.013","99.423","0.014","848","0.6","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H15 Cl2 N5 -","- C17 H15 Cl2 N5 -","- C34 H30 Cl4 N10 -","2","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.0693","0.0452","","","0.1157","0.1261","","","","","","1.079","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128342","7.9028","0.0007","12.5696","0.0008","20.7598","0.0018","90","","95.571","0.003","90","","2052.4","0.3","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H25 N3 -","- C25 H25 N3 -","- C100 H100 N12 -","4","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.0669","0.0452","","","0.118","0.1291","","","","","","1.052","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128343","13.3","0.007","7.486","0.004","14.731","0.007","90","","93.762","0.017","90","","1463.5","1.3","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H23 N3 -","- C16 H23 N3 -","- C64 H92 N12 -","4","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.115","0.0603","","","0.1287","0.1515","","","","","","1.008","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128344","11.812","0.006","11.965","0.006","13.312","0.006","115.153","0.014","99.218","0.015","109.557","0.014","1500.5","1.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H12 F3 N5 -","- C17 H12 F3 N5 -","- C68 H48 F12 N20 -","4","2","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.1023","0.0614","","","0.1417","0.1561","","","","","","1.049","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128345","7.229","0.002","7.692","0.002","13.893","0.004","100.422","0.01","93.394","0.011","101.959","0.011","739.5","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H10 F3 N5 -","- C16 H10 F3 N5 -","- C32 H20 F6 N10 -","2","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.0566","0.0371","","","0.0991","0.1044","","","","","","0.999","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128346","14.645","0.005","12.306","0.003","10.398","0.003","90","","96.185","0.01","90","","1863","0.9","220","2","220","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H23 N5 O -","- C21 H23 N5 O -","- C84 H92 N20 O4 -","4","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.13","0.0636","","","0.154","0.1867","","","","","","1.012","","","","has coordinates,has disorder","267021","2021-07-05","16:18:06",""
"7128347","6.858","0.002","15.868","0.005","17.842","0.005","66.888","0.009","89.896","0.01","82.855","0.01","1769.6","0.9","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H21 N5 -","- C20 H21 N5 -","- C80 H84 N20 -","4","2","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.1381","0.0726","","","0.1696","0.1983","","","","","","1.043","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128348","13.043","0.004","16.924","0.005","7.147","0.002","90","","97.239","0.017","90","","1565.1","0.8","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H21 N5 -","- C16 H21 N5 -","- C64 H84 N20 -","4","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.1049","0.0609","","","0.1646","0.1883","","","","","","1.046","","","","has coordinates,has disorder","267021","2021-07-05","16:18:06",""
"7128349","8.6431","0.0016","15.692","0.002","13.006","0.002","90","","91.965","0.006","90","","1762.9","0.5","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N5 -","- C20 H21 N5 -","- C80 H84 N20 -","4","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.0459","0.0407","","","0.1155","0.1196","","","","","","1.038","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128350","14.323","0.006","15.575","0.007","14.988","0.007","90","","103.939","0.015","90","","3245","3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H37 F3 N6 O -","- C36 H37 F3 N6 O -","- C144 H148 F12 N24 O4 -","4","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.1458","0.0859","","","0.2298","0.2667","","","","","","1.042","","","","has coordinates,has disorder","267021","2021-07-05","16:18:06",""
"7128351","19.342","0.007","7.811","0.003","27.328","0.01","90","","90","","90","","4129","3","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C25 H23 N5 -","- C25 H23 N5 -","- C200 H184 N40 -","8","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.0554","0.0432","","","0.1143","0.122","","","","","","1.065","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128352","7.2146","0.0014","11.816","0.002","16.161","0.004","90","","102.558","0.007","90","","1344.7","0.5","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H12 F N5 -","- C16 H12 F N5 -","- C64 H48 F4 N20 -","4","2","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.0496","0.0348","","","0.0797","0.0827","","","","","","0.988","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128353","14.919","0.006","16.332","0.006","8.526","0.003","90","","92.459","0.014","90","","2075.5","1.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H40 I2 N8 -","- C38 H40 I2 N8 -","- C76 H80 I4 N16 -","2","0.5","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.0909","0.0536","","","0.1232","0.1374","","","","","","1.027","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128354","32.987","0.016","16.616","0.007","11.427","0.005","90","","105.17","0.02","90","","6045","5","149","2","149","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H25 F3 N6 -","- C26 H25 F3 N6 -","- C208 H200 F24 N48 -","8","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.1845","0.0967","","","0.2684","0.311","","","","","","1.045","","","","has coordinates,has disorder","267021","2021-07-05","16:18:06",""
"7128355","12.612","0.007","19.074","0.012","8.914","0.005","90","","99.301","0.019","90","","2116","2","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H21 N5 -","- C24 H21 N5 -","- C96 H84 N20 -","4","1","","Liang, Qiuming; Hayashi, Kasumi; Zeng, Yimin; Jimenez-Santiago, Jose L; Song, Datong","Constructing fused N-heterocycles from unprotected mesoionic N-heterocyclic olefins and organic azides <i>via</i> diazo transfer.","Chemical communications (Cambridge, England)","2021","57","50","6137","6140","10.1039/d1cc02245h","","","0.71073","MoKα","","0.1365","0.0797","","","0.2278","0.2595","","","","","","1.054","","","","has coordinates","267021","2021-07-05","16:18:06",""
"7128356","15.0815","0.0008","11.828","0.0006","12.836","0.0007","90","","113.055","0.003","90","","2106.9","0.2","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ni-P_8e","Ni-P_8e","","- C60 H28 N4 Ni -","- C60 H28 N4 Ni -","- C120 H56 N8 Ni2 -","2","0.5","","Chida, Koki; Yoshii, Takeharu; Takahashi, Kazuma; Yamamoto, Masanori; Kanamaru, Kazuya; Ohwada, Mao; Deerattrakul, Varisara; Maruyama, Jun; Kamiya, Kazuhide; Hayasaka, Yuichiro; Inoue, Masataka; Tani, Fumito; Nishihara, Hirotomo","Force-responsive ordered carbonaceous frameworks synthesized from Ni-porphyrin.","Chemical communications (Cambridge, England)","2021","57","49","6007","6010","10.1039/d1cc01618k","powder diffraction","","1.54186","CuKα","","","","","","","","","0.0311","2.1409","","","","","","","has coordinates","267040","2021-07-05","16:22:38",""
"7128357","36.6049","0.0006","36.6049","0.0006","36.6049","0.0006","90","","90","","90","","49047.6","1.4","173","2","173","2","","","","","","","","6","F m -3 m","-F 4 2 3","225","","","","- C108 H60 Cl6 N6 O40 Zr12 -","- C108 H60 Cl6 N6 O40 Zr12 -","- C864 H480 Cl48 N48 O320 Zr96 -","8","0.0416667","","Liu, Guoliang; Yang, Ziqi; Zhou, Mi; Wang, Yuxiang; Yuan, Daqiang; Zhao, Dan","Heterogeneous postassembly modification of zirconium metal-organic cages in supramolecular frameworks.","Chemical communications (Cambridge, England)","2021","57","51","6276","6279","10.1039/d1cc01606g","","","1.54184","CuKα","","0.1268","0.0889","","","0.2618","0.3196","","","","","","1.022","","","","has coordinates","266996","2021-07-05","16:12:02",""
"7128358","14.6283","0.0011","14.6283","0.0011","7.9366","0.0005","90","","90","","120","","1470.8","0.18","150","0.2","150","0.2","","","","","","","","4","P -3","-P 3","147","","","","- C25 H57 Li N6 -","- C25 H56.9997 Li N6 -","- C50 H113.999 Li2 N12 -","2","0.333333","","Davison, Nathan; Falbo, Emanuele; Waddell, Paul G.; Penfold, Thomas J.; Lu, Erli","A monomeric methyllithium complex: synthesis and structure.","Chemical communications (Cambridge, England)","2021","57","50","6205","6208","10.1039/d1cc01420j","","x-ray","1.54184","CuKα","","0.0696","0.0473","","","0.1034","0.1157","","","","","","0.956","","","","has coordinates,has disorder","267022","2021-07-05","16:18:17",""
"7128359","24.7909","0.0008","14.7339","0.0004","22.7185","0.0008","90","","101.23","0.003","90","","8139.4","0.5","100","","100","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","","- C42 H48 N6 -","- C42 H48 N6 -","- C336 H384 N48 -","8","1","","He, Donglin; Clowes, Rob; Little, Marc A.; Liu, Ming; Cooper, Andrew I.","Creating porosity in a trianglimine macrocycle by heterochiral pairing.","Chemical communications (Cambridge, England)","2021","57","50","6141","6144","10.1039/d1cc01650d","","x-ray","0.71073","MoKα","","0.1002","0.0628","","","0.1346","0.1503","","","","","","1.042","","","","has coordinates","267024","2021-07-05","16:18:52",""
"7128360","11.1919","0.00007","15.1847","0.00008","15.7355","0.00008","104.505","0.0004","91.577","0.0005","105.639","0.0005","2480.11","0.03","100","","100","","","","","","","","","3","P -1","-P 1","2","","","","- C58 H68 N6 -","- C58 H68 N6 -","- C116 H136 N12 -","2","1","","He, Donglin; Clowes, Rob; Little, Marc A.; Liu, Ming; Cooper, Andrew I.","Creating porosity in a trianglimine macrocycle by heterochiral pairing.","Chemical communications (Cambridge, England)","2021","57","50","6141","6144","10.1039/d1cc01650d","","x-ray","0.6889","Synchrotron","","0.0741","0.0674","","","0.1899","0.1955","","","","","","1.077","","","","has coordinates,has disorder","267024","2021-07-05","16:18:52",""
"7128361","14.3324","0.0006","14.3555","0.0006","25.1851","0.0009","89.815","0.003","77.839","0.004","60.849","0.004","4393.8","0.4","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C92 H112 N12 O6 -","- C92 H112 N12 O6 -","- C184 H224 N24 O12 -","2","1","","He, Donglin; Clowes, Rob; Little, Marc A.; Liu, Ming; Cooper, Andrew I.","Creating porosity in a trianglimine macrocycle by heterochiral pairing.","Chemical communications (Cambridge, England)","2021","57","50","6141","6144","10.1039/d1cc01650d","","x-ray","0.71073","MoKα","","0.1241","0.0821","","","0.2118","0.2277","","","","","","1.203","","","","has coordinates,has disorder","267024","2021-07-05","16:18:52",""
"7128362","20.45","0.002","20.45","0.002","5.9423","0.0005","90","","90","","120","","2152.1","0.3","100","","100","","","","","","","","","4","P 63","P 6c","173","","","","- C42.75 H51 N6 O0.75 -","- C42.75 H51 N6 O0.75 -","- C85.5 H102 N12 O1.5 -","2","0.333333","","He, Donglin; Clowes, Rob; Little, Marc A.; Liu, Ming; Cooper, Andrew I.","Creating porosity in a trianglimine macrocycle by heterochiral pairing.","Chemical communications (Cambridge, England)","2021","57","50","6141","6144","10.1039/d1cc01650d","","x-ray","0.71073","MoKα","","0.0757","0.0646","","","0.1554","0.1637","","","","","","1.078","","","","has coordinates,has disorder","267024","2021-07-05","16:18:52",""
"7128363","25.2103","0.0004","14.0669","0.0002","25.3934","0.0004","90","","102.506","0.002","90","","8791.6","0.2","100","","100","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C50 H58 N6 -","- C50 H58 N6 -","- C400 H464 N48 -","8","1","","He, Donglin; Clowes, Rob; Little, Marc A.; Liu, Ming; Cooper, Andrew I.","Creating porosity in a trianglimine macrocycle by heterochiral pairing.","Chemical communications (Cambridge, England)","2021","57","50","6141","6144","10.1039/d1cc01650d","","x-ray","0.71073","MoKα","","0.0963","0.0637","","","0.1397","0.1559","","","","","","1.015","","","","has coordinates","267024","2021-07-05","16:18:52",""
"7128364","29.9687","0.0005","22.3149","0.0003","14.6297","0.0002","90","","103.221","0.002","90","","9524.3","0.3","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C108 H126.2 N12 O0.1 -","- C108 H126 N12 O0.1 -","- C432 H504 N48 O0.4 -","4","1","","He, Donglin; Clowes, Rob; Little, Marc A.; Liu, Ming; Cooper, Andrew I.","Creating porosity in a trianglimine macrocycle by heterochiral pairing.","Chemical communications (Cambridge, England)","2021","57","50","6141","6144","10.1039/d1cc01650d","","x-ray","0.71073","MoKα","","0.0999","0.0668","","","0.1351","0.1481","","","","","","1.065","","","","has coordinates,has disorder","267024","2021-07-05","16:18:52",""
"7128365","17.099","0.0017","18.593","0.002","21.71","0.002","110.622","0.003","112.963","0.003","90.689","0.003","5857.8","1","150","2","150.08","","","","","","","","","4","P -1","-P 1","2","","","","- C198 H264 Al6 N18 -","- C198 H264 Al6 N18 -","- C198 H264 Al6 N18 -","1","0.5","","Chen, Weixing; Liu, Li; Zhao, Yanxia; Xue, Yujie; Xu, Wenhua; Li, Nan; Wu, Biao; Yang, Xiao-Juan","Organometallo-macrocycle assembled through dialumane-mediated C-H activation of pyridines.","Chemical communications (Cambridge, England)","2021","57","51","6268","6271","10.1039/d1cc00318f","","","0.71073","MoKα","","0.1689","0.0827","","","0.1623","0.1919","","","","","","1.033","","","","has coordinates","267000","2021-07-05","16:12:38",""
"7128366","12.469","0.008","13.297","0.008","19.852","0.013","90","","97.499","0.019","90","","3263","4","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C73 H98 Al2 N6 -","- C73 H97 Al2 N6 -","- C146 H194 Al4 N12 -","2","0.5","","Chen, Weixing; Liu, Li; Zhao, Yanxia; Xue, Yujie; Xu, Wenhua; Li, Nan; Wu, Biao; Yang, Xiao-Juan","Organometallo-macrocycle assembled through dialumane-mediated C-H activation of pyridines.","Chemical communications (Cambridge, England)","2021","57","51","6268","6271","10.1039/d1cc00318f","","","0.71073","MoKα","","0.1177","0.0988","","","0.2331","0.247","","","","","","1.086","","","","has coordinates","267000","2021-07-05","16:12:38",""
"7128367","14.224","0.003","11.946","0.002","19.65","0.004","90","","92.092","0.007","90","","3336.7","1.1","159","2","159","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C75 H102 Al2 N6 -","- C75 H101 Al2 N6 -","- C150 H202 Al4 N12 -","2","0.5","","Chen, Weixing; Liu, Li; Zhao, Yanxia; Xue, Yujie; Xu, Wenhua; Li, Nan; Wu, Biao; Yang, Xiao-Juan","Organometallo-macrocycle assembled through dialumane-mediated C-H activation of pyridines.","Chemical communications (Cambridge, England)","2021","57","51","6268","6271","10.1039/d1cc00318f","","","0.71073","MoKα","","0.0456","0.0408","","","0.0859","0.0884","","","","","","1.07","","","","has coordinates","267000","2021-07-05","16:12:38",""
"7128368","13.5982","0.0006","15.1449","0.0007","14.8412","0.0007","90","","92.994","0.002","90","","3052.3","0.2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C68 H94 Al2 N6 -","- C68 H94 Al2 N6 -","- C136 H188 Al4 N12 -","2","0.5","","Chen, Weixing; Liu, Li; Zhao, Yanxia; Xue, Yujie; Xu, Wenhua; Li, Nan; Wu, Biao; Yang, Xiao-Juan","Organometallo-macrocycle assembled through dialumane-mediated C-H activation of pyridines.","Chemical communications (Cambridge, England)","2021","57","51","6268","6271","10.1039/d1cc00318f","","","0.71073","MoKα","","0.0478","0.0415","","","0.1402","0.1483","","","","","","1.13","","","","has coordinates","267000","2021-07-05","16:12:38",""
"7128369","12.9942","0.0004","21.2069","0.0006","22.7887","0.0007","90","","90","","90","","6279.8","0.3","150","2","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C62 H87 Al2 N5 -","- C62 H87 Al2 N5 -","- C248 H348 Al8 N20 -","4","1","","Chen, Weixing; Liu, Li; Zhao, Yanxia; Xue, Yujie; Xu, Wenhua; Li, Nan; Wu, Biao; Yang, Xiao-Juan","Organometallo-macrocycle assembled through dialumane-mediated C-H activation of pyridines.","Chemical communications (Cambridge, England)","2021","57","51","6268","6271","10.1039/d1cc00318f","","","0.71073","MoKα","","0.0748","0.0519","","","0.0892","0.0979","","","","","","1.108","","","","has coordinates","267000","2021-07-05","16:12:38",""
"7128370","9.8863","0.0006","12.8738","0.0009","13.3885","0.0008","62.963","0.006","69.397","0.006","81.811","0.005","1420.4","0.18","93.15","","93.15","","","","","","","","","6","P -1","-P 1","2","","","","- C52 H48 As4 Au2 Cl8 Cu2 -","- C52 H48 As4 Au2 Cl8 Cu2 -","- C52 H48 As4 Au2 Cl8 Cu2 -","1","0.5","","Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Homo- and hetero-metallophilicity-driven synthesis of highly emissive and stimuli-responsive Au(I)-Cu(I) double salts.","Chemical communications (Cambridge, England)","2021","57","44","5382","5385","10.1039/d1cc01316e","","x-ray","0.71073","MoKα","","0.0506","0.0351","","","0.0615","0.0673","","","","","","0.988","","","","has coordinates","265834","2021-06-05","17:16:44",""
"7128371","9.9269","0.0003","12.6985","0.0008","13.1817","0.0008","110.431","0.006","111.146","0.005","98.196","0.004","1382.04","0.17","93.15","","93.15","","","","","","","","","6","P -1","-P 1","2","","","","- C52 H48 Au2 Cl8 Cu2 P4 -","- C52 H48 Au2 Cl8 Cu2 P4 -","- C52 H48 Au2 Cl8 Cu2 P4 -","1","0.5","","Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Homo- and hetero-metallophilicity-driven synthesis of highly emissive and stimuli-responsive Au(I)-Cu(I) double salts.","Chemical communications (Cambridge, England)","2021","57","44","5382","5385","10.1039/d1cc01316e","","x-ray","0.71073","MoKα","","0.0351","0.0281","","","0.0626","0.0659","","","","","","1.025","","","","has coordinates","265834","2021-06-05","17:16:45",""
"7128372","24.0857","0.0016","9.8217","0.0004","26.0584","0.0019","90","","116.602","0.009","90","","5511.9","0.7","93.15","","93.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51 H46 Au2 Cl6 Cu2 P4 -","- C51 H46 Au2 Cl6 Cu2 P4 -","- C204 H184 Au8 Cl24 Cu8 P16 -","4","0.5","","Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Homo- and hetero-metallophilicity-driven synthesis of highly emissive and stimuli-responsive Au(I)-Cu(I) double salts.","Chemical communications (Cambridge, England)","2021","57","44","5382","5385","10.1039/d1cc01316e","","x-ray","0.71073","MoKα","","0.0466","0.0321","","","0.0705","0.0764","","","","","","1.051","","","","has coordinates","265834","2021-06-05","17:16:45",""
"7128373","22.036","0.004","15.6209","0.0018","16.343","0.003","90","","114.38","0.006","90","","5124","1.5","298.15","","298.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C50 H44 As4 Au2 Cl4 Cu2 -","- C50 H44 As4 Au2 Cl4 Cu2 -","- C200 H176 As16 Au8 Cl16 Cu8 -","4","0.5","","Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Homo- and hetero-metallophilicity-driven synthesis of highly emissive and stimuli-responsive Au(I)-Cu(I) double salts.","Chemical communications (Cambridge, England)","2021","57","44","5382","5385","10.1039/d1cc01316e","","","0.71075","MoKα","","0.0817","0.0485","","","0.1168","0.1364","","","","","","1.044","","","","has coordinates,has disorder","265834","2021-06-05","17:16:45",""
"7128374","24.4022","0.0013","9.8331","0.0004","26.3594","0.0015","90","","116.103","0.007","90","","5679.8","0.6","93.15","","93.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.27 H46.55 As4 Au2 Cl6.55 Cu2 -","- C51.274 H46.548 As4 Au2 Cl6.548 Cu2 -","- C205.096 H186.192 As16 Au8 Cl26.192 Cu8 -","4","0.5","","Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Homo- and hetero-metallophilicity-driven synthesis of highly emissive and stimuli-responsive Au(I)-Cu(I) double salts.","Chemical communications (Cambridge, England)","2021","57","44","5382","5385","10.1039/d1cc01316e","","x-ray","0.71073","MoKα","","0.0477","0.0318","","","0.0695","0.0756","","","","","","1.031","","","","has coordinates,has disorder","265834","2021-06-05","17:16:45",""
"7128375","11.9552","0.0004","14.8332","0.0004","14.8676","0.0005","78.576","0.002","78.834","0.003","69.834","0.003","2403.25","0.14","93.15","","93.15","","","","","","","","","6","P -1","-P 1","2","","","","- C100 H88 Au4 Cl8 Cu4 P8 -","- C100 H88 Au4 Cl8 Cu4 P8 -","- C100 H88 Au4 Cl8 Cu4 P8 -","1","0.5","","Kobayashi, Ryosuke; Yumura, Takashi; Imoto, Hiroaki; Naka, Kensuke","Homo- and hetero-metallophilicity-driven synthesis of highly emissive and stimuli-responsive Au(I)-Cu(I) double salts.","Chemical communications (Cambridge, England)","2021","57","44","5382","5385","10.1039/d1cc01316e","","x-ray","0.71073","MoKα","","0.0709","0.0374","","","0.0587","0.0675","","","","","","0.988","","","","has coordinates","265834","2021-06-05","17:16:45",""
"7128376","9.5493","0.0006","14.0781","0.0008","7.7339","0.0005","86.029","0.005","89.324","0.005","79.883","0.005","1021.09","0.11","228","0.1","228","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C10 H24 Bi Cl6 K N2 -","- C10 H24 Bi Cl6 K N2 -","- C20 H48 Bi2 Cl12 K2 N4 -","2","1","","Meng, Qian-Ru; Xu, Wei-Jian; Hu, Wang-Hua; Ye, Hui; Chen, Xiao-Xian; Yuan, Wei; Zhang, Wei-Xiong; Chen, Xiao-Ming","An unprecedented hexagonal double perovskite organic-inorganic hybrid ferroelastic material: (piperidinium)<sub>2</sub>[KBiCl<sub>6</sub>].","Chemical communications (Cambridge, England)","2021","57","51","6292","6295","10.1039/d1cc02085d","","x-ray","0.71073","MoKα","","0.0417","0.0376","","","0.0856","0.0905","","","","","","1.077","","","","has coordinates","266999","2021-07-05","16:12:24",""
"7128377","17.4817","0.0009","7.7663","0.0004","7.7181","0.0003","90","","91.632","0.004","90","","1047.45","0.09","298","0.1","298","0.1","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C10 H24 Bi Cl6 K N2 -","- C10 H24 Bi Cl6 K N2 -","- C20 H48 Bi2 Cl12 K2 N4 -","2","0.25","","Meng, Qian-Ru; Xu, Wei-Jian; Hu, Wang-Hua; Ye, Hui; Chen, Xiao-Xian; Yuan, Wei; Zhang, Wei-Xiong; Chen, Xiao-Ming","An unprecedented hexagonal double perovskite organic-inorganic hybrid ferroelastic material: (piperidinium)<sub>2</sub>[KBiCl<sub>6</sub>].","Chemical communications (Cambridge, England)","2021","57","51","6292","6295","10.1039/d1cc02085d","","x-ray","0.71073","MoKα","","0.0206","0.0201","","","0.0384","0.0386","","","","","","1.034","","","","has coordinates,has disorder","266999","2021-07-05","16:12:25",""
"7128378","7.6819","0.0001","5.895","0.0001","20.1743","0.0001","90","","91.416","0.001","90","","913.31","0.02","100","0.1","100","0.1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H18 Br N O2 S -","- C20 H18 Br N O2 S -","- C40 H36 Br2 N2 O4 S2 -","2","1","","Wu, Hui-Min; Zhang, Zongpeng; Wei, Liang; Dong, Xiu-Qin; Wang, Chun-Jiang","Synergistic Cu/Pd-catalyzed asymmetric allylation: a facile access to α-quaternary cysteine derivatives.","Chemical communications (Cambridge, England)","2021","57","53","6538","6541","10.1039/d1cc01754c","","x-ray","1.54184","CuKα","","0.0214","0.0213","","","0.0579","0.0579","","","","","","1.08","","","","has coordinates","267007","2021-07-05","16:14:27",""
"7128379","25.049","0.002","10.4508","0.0009","36.994","0.003","90","","106.546","0.005","90","","9283.4","1.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H54 Cl0.99 Co N6 O6.97 -","- C40 H54 Cl0.991 Co N6 O6.964 -","- C320 H432 Cl7.928 Co8 N48 O55.712 -","8","1","","Bonanno, Nico M.; Watts, Zackery; Mauws, Cole; Patrick, Brian O.; Wiebe, Christopher R.; Shibano, Yuki; Sugisaki, Kenji; Matsuoka, Hideto; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Lemaire, Martin T.","Valence tautomerism in a [2 ×2] Co<sub>4</sub> grid complex containing a ditopic arylazo ligand.","Chemical communications (Cambridge, England)","2021","57","50","6213","6216","10.1039/d1cc01991k","","x-ray","0.71073","MoKα","","0.0835","0.0772","","","0.1786","0.1812","","","","","","1.112","","","","has coordinates,has disorder","267023","2021-07-05","16:18:31",""
"7128380","39.4401","0.0013","39.4401","0.0013","10.415","0.0005","90","","90","","90","","16200.8","1.1","100","2","100","2","","","","","","","","5","I -4","I -4","82","","","","- C128 H168 Co4 N24 O8 -","- C128 H168 Co4 N24 O8 -","- C512 H672 Co16 N96 O32 -","4","0.5","","Bonanno, Nico M.; Watts, Zackery; Mauws, Cole; Patrick, Brian O.; Wiebe, Christopher R.; Shibano, Yuki; Sugisaki, Kenji; Matsuoka, Hideto; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Lemaire, Martin T.","Valence tautomerism in a [2 ×2] Co<sub>4</sub> grid complex containing a ditopic arylazo ligand.","Chemical communications (Cambridge, England)","2021","57","50","6213","6216","10.1039/d1cc01991k","","x-ray","0.71073","MoKα","","0.0926","0.0681","","","0.1588","0.1693","","","","","","1.03","","","","has coordinates,has disorder","267023","2021-07-05","16:18:32",""
"7128381","7.32916","0.00012","16.4248","0.0002","18.857","0.0003","90","","100.201","0.0016","90","","2234.12","0.06","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H33 B O5 Si -","- C20 H33 B O5 Si -","- C80 H132 B4 O20 Si4 -","4","1","","Salvado, Oriol; Fernández, Elena","A modular olefination reaction between aldehydes and diborylsilylmethide lithium salts.","Chemical communications (Cambridge, England)","2021","57","51","6300","6303","10.1039/d1cc01882e","","","0.71075","MoKα","","0.033","0.0298","","","0.0884","0.0903","","","","","","1.045","","","","has coordinates","266997","2021-07-05","16:12:09",""
"7128382","10.9996","0.0006","12.127","0.0006","23.4345","0.0012","76.694","0.003","86.042","0.003","85.353","0.003","3028","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H30 N2 O -","- C39 H30 N2 O -","- C156 H120 N8 O4 -","4","2","","Changmai, Sumi; Sultana, Sabera; Sarma, Bipul; Gogoi, Sanjib","Pd(II)-Catalyzed alkyne annulation through allylic isomerization: synthesis of spiro-cyclopentadiene pyrazolones.","Chemical communications (Cambridge, England)","2021","57","49","6027","6030","10.1039/d1cc02155a","","","0.71073","MoKα","","0.1479","0.0606","","","0.1449","0.192","","","","","","0.937","","","","has coordinates","267038","2021-07-05","16:21:49",""
"7128383","10.6306","0.0008","15.1263","0.0011","17.9884","0.0014","90","","90","","90","","2892.6","0.4","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C38 H28 N2 O -","- C38 H28 N2 O -","- C152 H112 N8 O4 -","4","1","","Changmai, Sumi; Sultana, Sabera; Sarma, Bipul; Gogoi, Sanjib","Pd(II)-Catalyzed alkyne annulation through allylic isomerization: synthesis of spiro-cyclopentadiene pyrazolones.","Chemical communications (Cambridge, England)","2021","57","49","6027","6030","10.1039/d1cc02155a","","","0.71073","MoKα","","0.0832","0.0517","","","0.1127","0.1312","","","","","","1.024","","","","has coordinates","267038","2021-07-05","16:21:49",""
"7128384","12.4069","0.0003","13.0169","0.0003","19.7043","0.0004","76.2476","0.0016","89.8441","0.0017","86.8028","0.0016","3086.01","0.12","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C66 H101 B N4 O3 Sr -","- C66 H101 B N4 O3 Sr -","- C132 H202 B2 N8 O6 Sr2 -","2","1","","Höllerhage, Thomas; Carpentier, Ambre; Spaniol, Thomas P.; Maron, Laurent; Englert, Ulli; Okuda, Jun","Cationic strontium hydride complexes supported by an NNNN-type macrocycle.","Chemical communications (Cambridge, England)","2021","57","51","6316","6319","10.1039/d1cc02040d","","x-ray","1.54178","CuKα","","0.1116","0.1064","","","0.2691","0.2798","","","","","","1.321","","","","has coordinates,has disorder","267001","2021-07-05","16:13:00",""
"7128385","8.8102","0.0018","9.0828","0.0018","19.687","0.004","88.58","0.03","87.44","0.03","70.78","0.03","1486","0.6","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H50 N4 O Sr -","- C30 H50 N4 O Sr -","- C60 H100 N8 O2 Sr2 -","2","1","","Höllerhage, Thomas; Carpentier, Ambre; Spaniol, Thomas P.; Maron, Laurent; Englert, Ulli; Okuda, Jun","Cationic strontium hydride complexes supported by an NNNN-type macrocycle.","Chemical communications (Cambridge, England)","2021","57","51","6316","6319","10.1039/d1cc02040d","","x-ray","1.54178","CuKα","","0.0238","0.021","","","0.0553","0.0561","","","","","","1.048","","","","has coordinates,has disorder","267001","2021-07-05","16:13:01",""
"7128386","22.3924","0.0003","12.75071","0.00015","35.5684","0.0004","90","","101.73","0.0009","90","","9943.4","0.2","100","","100","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C204 H316 B4 Ca2.52 N16 O7 Sr1.49 -","- C204 H316 B4 Ca2.514 N16 O7 Sr1.486 -","- C408 H632 B8 Ca5.028 N32 O14 Sr2.972 -","2","0.5","","Höllerhage, Thomas; Carpentier, Ambre; Spaniol, Thomas P.; Maron, Laurent; Englert, Ulli; Okuda, Jun","Cationic strontium hydride complexes supported by an NNNN-type macrocycle.","Chemical communications (Cambridge, England)","2021","57","51","6316","6319","10.1039/d1cc02040d","","x-ray","1.54178","CuKα","","0.0744","0.0431","","","0.0936","0.1006","","","","","","0.857","","","","has coordinates,has disorder","267001","2021-07-05","16:13:01",""
"7128387","17.2794","0.0002","24.7939","0.0004","28.3335","0.0005","109.873","0.0012","90.2679","0.0012","90.7112","0.0012","11414.5","0.3","100","","100","","","","","","","","","7","P -1","-P 1","2","compound 4","","","- C228 H375.93 B4 I0.07 N24 O7 Sr6 -","- C208 H335.93 B4 I0.07 N24 O2 Sr6 -","- C416 H671.86 B8 I0.14 N48 O4 Sr12 -","2","1","","Höllerhage, Thomas; Carpentier, Ambre; Spaniol, Thomas P.; Maron, Laurent; Englert, Ulli; Okuda, Jun","Cationic strontium hydride complexes supported by an NNNN-type macrocycle.","Chemical communications (Cambridge, England)","2021","57","51","6316","6319","10.1039/d1cc02040d","","x-ray","1.54178","CuKα","","0.0932","0.067","","","0.1616","0.1788","","","","","","1.014","","","","has coordinates,has disorder","287892","2023-11-30","16:04:10",""
"7128388","23.318","0.011","8.609","0.004","8.942","0.004","90","","94.033","0.006","90","","1790.6","1.4","296","2","296.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- B2 Ba5 Cl2 S8 -","- B2 Ba5 Cl2 S8 -","- B8 Ba20 Cl8 S32 -","4","0.5","","Zhou, Jiazheng; Chu, Yu; Li, Junjie; Pan, Shilie","Ba<sub>2</sub>BS<sub>3</sub>Cl and Ba<sub>5</sub>B<sub>2</sub>S<sub>8</sub>Cl<sub>2</sub>: first alkaline-earth metal thioborate halides with [BS<sub>3</sub>] units.","Chemical communications (Cambridge, England)","2021","57","52","6440","6443","10.1039/d1cc01510a","","","0.71073","MoKα","","0.033","0.0277","","","0.0588","0.0609","","","","","","1.027","","","","has coordinates","267010","2021-07-05","16:15:15",""
"7128389","8.617","0.002","8.999","0.003","9.323","0.003","90","","90","","90","","722.9","0.4","296","2","296.15","","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- B Ba2 Cl S3 -","- B Ba2 Cl S3 -","- B4 Ba8 Cl4 S12 -","4","0.5","","Zhou, Jiazheng; Chu, Yu; Li, Junjie; Pan, Shilie","Ba<sub>2</sub>BS<sub>3</sub>Cl and Ba<sub>5</sub>B<sub>2</sub>S<sub>8</sub>Cl<sub>2</sub>: first alkaline-earth metal thioborate halides with [BS<sub>3</sub>] units.","Chemical communications (Cambridge, England)","2021","57","52","6440","6443","10.1039/d1cc01510a","","","0.71073","MoKα","","0.0267","0.0222","","","0.0475","0.0491","","","","","","1.074","","","","has coordinates","267010","2021-07-05","16:15:15",""
"7128390","14.2727","0.0006","9.0999","0.0004","20.3049","0.001","90","","101.367","0.004","90","","2585.5","0.2","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H27 N O4 S -","- C31 H27 N O4 S -","- C124 H108 N4 O16 S4 -","4","1","","Kumar, Shreemoyee; Nair, Akshay M.; Volla, Chandra M. R.","Ru(II)-catalyzed allenylation and sequential annulation of <i>N</i>-tosylbenzamides with propargyl alcohols.","Chemical communications (Cambridge, England)","2021","57","51","6280","6283","10.1039/d1cc01768c","","x-ray","0.71073","MoKα","","0.0731","0.0498","","","0.1114","0.1313","","","","","","1.063","","","","has coordinates","266998","2021-07-05","16:12:17",""
"7128391","6.7413","0.0005","11.063","0.0008","11.1739","0.0008","65.911","0.002","76.843","0.003","81.307","0.003","739.2","0.09","253","2","253","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H19 Br O -","- C16 H19 Br O -","- C32 H38 Br2 O2 -","2","1","","Kimaru, Natsuki; Komatsuki, Keiichi; Saito, Kodai; Yamada, Tohru","Decarboxylation-triggered homo-Nazarov cyclization of cyclic enol carbonates catalyzed by rhenium complex.","Chemical communications (Cambridge, England)","2021","57","50","6133","6136","10.1039/d1cc01144h","","","0.71073","MoKα","","0.0543","0.0481","","","0.1466","0.15","","","","","","1.53","","","","has coordinates","267025","2021-07-05","16:19:00",""
"7128392","20.086","0.0005","10.8034","0.0003","12.6109","0.0004","90","","106.226","0.001","90","","2627.52","0.13","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 O -","- C15 H18 O -","- C120 H144 O8 -","8","2","","Kimaru, Natsuki; Komatsuki, Keiichi; Saito, Kodai; Yamada, Tohru","Decarboxylation-triggered homo-Nazarov cyclization of cyclic enol carbonates catalyzed by rhenium complex.","Chemical communications (Cambridge, England)","2021","57","50","6133","6136","10.1039/d1cc01144h","","","0.71073","MoKα","","0.0745","0.062","","","0.1774","0.1888","","","","","","1.069","","","","has coordinates","267025","2021-07-05","16:19:00",""
"7128393","4.1619","0.0007","13.023","0.002","21.315","0.004","90","","90","","90","","1155.3","0.3","296","2","296.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H11 N O2 -","- C15 H11 N O2 -","- C60 H44 N4 O8 -","4","1","","Zhou, Zhan-Yu; Xu, Zhong-Yang; Shen, Qiao-Yu; Huang, Li-Sha; Zhang, Xing; Xia, Ai-Bao; Xu, Dan-Qian; Xu, Zhen-Yuan","<i>In situ</i> generation of highly reactive allenes from nitrocyclopropanes: controllable synthesis of enynes and enesters.","Chemical communications (Cambridge, England)","2021","57","52","6424","6427","10.1039/d1cc01573g","","","0.71073","MoKα","","0.0866","0.0393","","","0.105","0.1413","","","","","","0.835","","","","has coordinates","267012","2021-07-05","16:15:39",""
"7128394","9.5108","0.0002","9.997","0.0002","14.6139","0.0003","87.758","0.001","89.571","0.001","80.969","0.001","1371.21","0.05","170","2","170.01","","","","","","","","","3","P -1","-P 1","2","","","","- C30 H32 O8 -","- C30 H32 O8 -","- C60 H64 O16 -","2","1","","Zhou, Zhan-Yu; Xu, Zhong-Yang; Shen, Qiao-Yu; Huang, Li-Sha; Zhang, Xing; Xia, Ai-Bao; Xu, Dan-Qian; Xu, Zhen-Yuan","<i>In situ</i> generation of highly reactive allenes from nitrocyclopropanes: controllable synthesis of enynes and enesters.","Chemical communications (Cambridge, England)","2021","57","52","6424","6427","10.1039/d1cc01573g","","","1.34139","GaKα","","0.0564","0.045","","","0.1034","0.1119","","","","","","1.074","","","","has coordinates","267012","2021-07-05","16:15:40",""
"7128395","14.1448","0.0001","21.9288","0.0001","26.0721","0.0002","90","","98.309","0.001","90","","8002.12","0.09","100","0.1","100","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C78 H136 B3 Dy3 -","- C78 H136 B3 Dy3 -","- C312 H544 B12 Dy12 -","4","1","","He, Mian; Guo, Fu-Sheng; Tang, Jinkui; Mansikkamäki, Akseli; Layfield, Richard A.","Synthesis and single-molecule magnet properties of a trimetallic dysprosium metallocene cation.","Chemical communications (Cambridge, England)","2021","57","52","6396","6399","10.1039/d1cc02139g","","x-ray","1.54184","CuKα","","0.0458","0.0402","","","0.0999","0.104","","","","","","1.021","","","","has coordinates,has disorder","267014","2021-07-05","16:15:57",""
"7128396","14.2955","0.0005","17.6222","0.0007","19.9866","0.0006","80.945","0.003","88.122","0.003","88.861","0.003","4969","0.3","100","0.11","100","0.11","","","","","","","","5","P -1","-P 1","2","","","","- C102 H132 B3 Dy3 F20 -","- C102 H132 B3 Dy3 F20 -","- C204 H264 B6 Dy6 F40 -","2","1","","He, Mian; Guo, Fu-Sheng; Tang, Jinkui; Mansikkamäki, Akseli; Layfield, Richard A.","Synthesis and single-molecule magnet properties of a trimetallic dysprosium metallocene cation.","Chemical communications (Cambridge, England)","2021","57","52","6396","6399","10.1039/d1cc02139g","","x-ray","1.54184","CuKα","","0.0611","0.0474","","","0.1141","0.1225","","","","","","1.015","","","","has coordinates","267014","2021-07-05","16:15:58",""
"7128397","5.0662","0.0002","12.5792","0.0008","10.2257","0.0006","90","","100.078","0.003","90","","641.62","0.06","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","alpha-III","","- H5 O7 P2 Ti -","- H5 O7 P2 Ti -","- H20 O28 P8 Ti4 -","4","1","","Hung, Ling-I; Hsieh, Tsung-Hsiu; Syu, Jhao-Yang; Chen, Pei-Lin; Lin, Chia-Her; Wang, Sue-Lein","A titanium(iii) phosphite exhibits polymorph-distinct redox activity involving proton-coupled electron transfer.","Chemical communications (Cambridge, England)","2021","57","53","6542","6545","10.1039/d1cc01190a","","","0.71073","MoKα","","0.0321","0.0258","","","0.0682","0.0722","","","","","","1.118","","","","has coordinates,has disorder","267002","2021-07-05","16:13:22",""
"7128398","7.0671","0.001","7.3832","0.001","12.0992","0.0016","90","","102.341","0.004","90","","616.72","0.15","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- H4 O7 P2 Ti -","- H4 O7 P2 Ti -","- H16 O28 P8 Ti4 -","4","1","","Hung, Ling-I; Hsieh, Tsung-Hsiu; Syu, Jhao-Yang; Chen, Pei-Lin; Lin, Chia-Her; Wang, Sue-Lein","A titanium(iii) phosphite exhibits polymorph-distinct redox activity involving proton-coupled electron transfer.","Chemical communications (Cambridge, England)","2021","57","53","6542","6545","10.1039/d1cc01190a","","","0.71073","MoKα","","0.0422","0.0362","","","0.0965","0.0995","","","","","","1.154","","","","has coordinates","267002","2021-07-05","16:13:22",""
"7128399","7.4859","0.0006","7.5154","0.0006","12.1997","0.001","90","","102.801","0.002","90","","669.29","0.09","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- H5 O7 P2 Ti -","- H5 O7 P2 Ti -","- H20 O28 P8 Ti4 -","4","1","","Hung, Ling-I; Hsieh, Tsung-Hsiu; Syu, Jhao-Yang; Chen, Pei-Lin; Lin, Chia-Her; Wang, Sue-Lein","A titanium(iii) phosphite exhibits polymorph-distinct redox activity involving proton-coupled electron transfer.","Chemical communications (Cambridge, England)","2021","57","53","6542","6545","10.1039/d1cc01190a","","","0.71073","MoKα","","0.0436","0.0395","","","0.084","0.0857","","","","","","1.095","","","","has coordinates,has disorder","267002","2021-07-05","16:13:22",""
"7128400","5.0907","0.0003","12.1407","0.0007","10.2327","0.0006","90","","102.663","0.003","90","","617.05","0.06","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- H4 O7 P2 Ti -","- H4 O7 P2 Ti -","- H16 O28 P8 Ti4 -","4","1","","Hung, Ling-I; Hsieh, Tsung-Hsiu; Syu, Jhao-Yang; Chen, Pei-Lin; Lin, Chia-Her; Wang, Sue-Lein","A titanium(iii) phosphite exhibits polymorph-distinct redox activity involving proton-coupled electron transfer.","Chemical communications (Cambridge, England)","2021","57","53","6542","6545","10.1039/d1cc01190a","","","0.71073","MoKα","","0.062","0.0399","","","0.0957","0.1044","","","","","","1.128","","","","has coordinates,has disorder","267002","2021-07-05","16:13:22",""
"7128401","6.5241","0.0002","9.3333","0.0003","27.7177","0.0009","90","","90.516","0.003","90","","1687.7","0.09","150","0.1","150","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H26 Cl6 N2 O2 S2 -","- C34 H26 Cl6 N2 O2 S2 -","- C68 H52 Cl12 N4 O4 S4 -","2","0.5","","Mastropasqua Talamo, Maurizio; Pop, Flavia; Avarvari, Narcis","Straightforward <i>N</i>-alkylation of diketopyrrolopyrroles through the Mitsunobu reaction with benzyl, α-branched, and chiral alcohols.","Chemical communications (Cambridge, England)","2021","57","53","6514","6517","10.1039/d1cc02472h","","","1.54184","CuKα","","0.0489","0.0439","","","0.113","0.118","","","","","","1.042","","","","has coordinates,has disorder","267003","2021-07-05","16:13:30",""
"7128402","13.0653","0.0011","5.5363","0.0003","16.2264","0.001","90","","109.093","0.008","90","","1109.14","0.14","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H28 N2 O2 S2 -","- C24 H28 N2 O2 S2 -","- C48 H56 N4 O4 S4 -","2","0.5","","Mastropasqua Talamo, Maurizio; Pop, Flavia; Avarvari, Narcis","Straightforward <i>N</i>-alkylation of diketopyrrolopyrroles through the Mitsunobu reaction with benzyl, α-branched, and chiral alcohols.","Chemical communications (Cambridge, England)","2021","57","53","6514","6517","10.1039/d1cc02472h","","","1.54184","CuKα","","0.0526","0.0455","","","0.1224","0.1312","","","","","","1.05","","","","has coordinates,has disorder","267003","2021-07-05","16:13:31",""
"7128403","11.5078","0.0009","5.6097","0.0004","16.8043","0.0011","90","","106.234","0.008","90","","1041.55","0.14","200.4","0.6","200.4","0.6","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H26 N4 O2 -","- C24 H26 N4 O2 -","- C48 H52 N8 O4 -","2","0.5","","Mastropasqua Talamo, Maurizio; Pop, Flavia; Avarvari, Narcis","Straightforward <i>N</i>-alkylation of diketopyrrolopyrroles through the Mitsunobu reaction with benzyl, α-branched, and chiral alcohols.","Chemical communications (Cambridge, England)","2021","57","53","6514","6517","10.1039/d1cc02472h","","","1.54184","CuKα","","0.0622","0.0548","","","0.1372","0.143","","","","","","1.074","","","","has coordinates,has disorder","267003","2021-07-05","16:13:31",""
"7128404","10.6491","0.0007","10.9218","0.0007","16.5496","0.0011","76.8917","0.0014","72.639","0.0014","64.8651","0.0014","1652","0.19","200","2","200","2","","","","","","","","6","P 1","P 1","1","","","","- C40.5 H31 Br Cl N2 O2 -","- C40.5 H31 Br Cl N2 O2 -","- C81 H62 Br2 Cl2 N4 O4 -","2","2","","Zhang, Wande; Wei, Shiqiang; Wang, Wenyao; Qu, Jingping; Wang, Baomin","Catalytic asymmetric construction of C-4 alkenyl substituted pyrazolone derivatives bearing multiple stereoelements.","Chemical communications (Cambridge, England)","2021","57","53","6550","6553","10.1039/d1cc01123e","","","0.71073","MoKα","","0.0708","0.0467","","","0.1134","0.1223","","","","","","1.042","","","","has coordinates","267005","2021-07-05","16:14:11",""
"7128405","11.0439","0.0003","5.6164","0.0002","12.2401","0.0003","90","","97.184","0.002","90","","753.26","0.04","150","2","150","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H19 N O4 -","- C17 H19 N O4 -","- C34 H38 N2 O8 -","2","1","","Dunås, Petter; Paterson, Andrew J.; Kociok-Köhn, Gabriele; Rahm, Martin; Lewis, Simon E.; Kann, Nina","Palladium-catalyzed stereoselective domino arylation-acylation: an entry to chiral tetrahydrofluorenone scaffolds.","Chemical communications (Cambridge, England)","2021","57","53","6518","6521","10.1039/d1cc02160e","","x-ray","1.54184","CuKα","","0.036","0.0334","","","0.0835","0.0851","","","","","","1.046","","","","has coordinates","267008","2021-07-05","16:14:33",""
"7128406","17.589","0.001","17.0252","0.001","26.7962","0.0014","90","","106.593","0.002","90","","7690.1","0.8","113","2","113.03","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C126 H53 N4 Ni S2 Th -","- C126 H53 N4 Ni S2 Th1.0006 -","- C504 H212 N16 Ni4 S8 Th4.0024 -","4","1","","Yan, Yingjing; Morales-Martínez, Roser; Zhuang, Jiaxin; Yao, Yang-Rong; Li, Xiaomeng; Poblet, Josep M.; Rodríguez-Fortea, Antonio; Chen, Ning","Th@<i>D</i><sub>5h</sub>(6)-C<sub>80</sub>: a highly symmetric fullerene cage stabilized by a single metal ion.","Chemical communications (Cambridge, England)","2021","57","54","6624","6627","10.1039/d1cc02339j","","","1.54178","CuKα","","0.0901","0.0874","","","0.2275","0.2299","","","","","","1.03","","","","has coordinates,has disorder","268597","2021-09-06","09:37:48",""
"7128407","12.0838","0.0007","15.3449","0.0009","16.0627","0.001","84.6388","0.0014","89.249","0.0014","88.299","0.0012","2963.9","0.3","298","","298","","","","","","","","","4","P -1","-P 1","2","","","","- C64 H69 Cl3 O10 -","- C64 H69 Cl3 O10 -","- C128 H138 Cl6 O20 -","2","1","","Li, Zheng; Li, Lu; Wang, Yan; Yang, Ying-Wei","Pillararene-enriched linear conjugated polymer materials with thiazolo[5,4-<i>d</i>]thiazole linkages for photocatalysis.","Chemical communications (Cambridge, England)","2021","57","53","6546","6549","10.1039/d1cc02373j","","","0.71073","MoKα","","0.2327","0.1064","","","0.287","0.3827","","","","","","1.003","","","","has coordinates,has disorder","298703","2025-04-03","05:34:20",""
"7128408","3.927","0.004","11.665","0.012","27.84","0.03","90","","90","","90","","1275","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H7 Cl3 O2 -","- C13 H7 Cl3 O2 -","- C52 H28 Cl12 O8 -","4","1","","Saha, Subhankar; Desiraju, Gautam R.","Reply to the 'Comment on ""Trimorphs of 4-bromophenyl 4-bromobenzoate. Elastic, brittle, plastic""' by J. J. Whittaker, A. J. Brock, A. Grosjean, M. C. Pfrunder, J. C. McMurtrie and J. K. Clegg, <i>Chem. Commun.</i>, 2021, <b>57</b>, DOI: 10.1039/D0CC07668F.","Chemical communications (Cambridge, England)","2021","57","40","4976","4978","10.1039/d1cc00159k","","","0.71073","MoKα","","0.0726","0.0623","","","0.1233","0.1294","","","","","","1.083","","","","has coordinates","265777","2021-06-04","08:05:49",""
"7128409","24.9668","0.0012","24.9668","0.0012","44.274","0.0011","90","","90","","120","","23900.4","1.7","103","2","103.15","","","","","","","","","7","P -3 c 1","-P 3 2""c","165","","","","- C132 H93 Ag29 N13 Na4 O3 S24 -","- C132 H93 Ag29 N13 Na4 O3 S24 -","- C528 H372 Ag116 N52 Na16 O12 S96 -","4","0.333333","","Ishii, Wataru; Katao, Shohei; Nishikawa, Yoshiko; Okajima, Yasuo; Hatori, Atsuya; Ehara, Masahiro; Kawai, Tsuyoshi; Nakashima, Takuya","The emergence of intense near-infrared photoluminescence by photoactivation of silver nanoclusters.","Chemical communications (Cambridge, England)","2021","57","53","6483","6486","10.1039/d1cc02119b","","x-ray","0.71075","MoKα","","0.1174","0.0867","","","0.2944","0.3369","","","","","","1.076","","","","has coordinates,has disorder","267009","2021-07-05","16:14:49",""
"7128410","21.9574","0.001","5.9872","0.0003","14.5153","0.0008","90","","92.023","0.005","90","","1907.04","0.17","293","2","293","2","","","","","","","","4","I 1 2 1","I 2y","5","","","","- C21 H21 N O5 -","- C21 H21 N O5 -","- C84 H84 N4 O20 -","4","1","","Zhang, Min; He, Xue-Wen; Xiong, Ya; Zuo, Xiong; Zhou, Wei; Liu, Xiong-Li","Asymmetric construction of six vicinal stereogenic centers on hexahydroxanthones <i>via</i> organocatalytic one-pot reactions.","Chemical communications (Cambridge, England)","2021","57","55","6764","6767","10.1039/d1cc02570h","","x-ray","1.54184","CuKα","","0.0713","0.0636","","","0.1766","0.1874","","","","","","1.083","","","","has coordinates","268513","2021-09-06","09:03:51",""
"7128411","12.5529","0.0007","6.608","0.0005","19.3655","0.0012","90","","90","","90","","1606.36","0.18","149.99","0.1","149.99","0.1","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C18 H10 Br2 O4 -","- C18 H10 Br2 O4 -","- C72 H40 Br8 O16 -","4","0.5","","Zhang, Min; He, Xue-Wen; Xiong, Ya; Zuo, Xiong; Zhou, Wei; Liu, Xiong-Li","Asymmetric construction of six vicinal stereogenic centers on hexahydroxanthones <i>via</i> organocatalytic one-pot reactions.","Chemical communications (Cambridge, England)","2021","57","55","6764","6767","10.1039/d1cc02570h","","x-ray","1.54184","CuKα","","0.1041","0.0995","","","0.2587","0.2644","","","","","","1.097","","","","has coordinates","268513","2021-09-06","09:03:52",""
"7128412","23.3436","0.0014","4.9735","0.0003","11.5943","0.0005","90","","90","","90","","1346.09","0.13","149.99","0.1","149.99","0.1","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C18 H12 O4 -","- C18 H12 O4 -","- C72 H48 O16 -","4","1","","Zhang, Min; He, Xue-Wen; Xiong, Ya; Zuo, Xiong; Zhou, Wei; Liu, Xiong-Li","Asymmetric construction of six vicinal stereogenic centers on hexahydroxanthones <i>via</i> organocatalytic one-pot reactions.","Chemical communications (Cambridge, England)","2021","57","55","6764","6767","10.1039/d1cc02570h","","x-ray","1.54184","CuKα","","0.0364","0.0348","","","0.0876","0.09","","","","","","1.074","","","","has coordinates","268513","2021-09-06","09:03:52",""
"7128413","15.469","0.004","15.469","0.004","14.15","0.006","90","","90","","120","","2932.3","1.6","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C12 H15.33 Co1.67 N2 O9.33 S -","- C12 H8 Co1.66667 N2 O9.33317 S -","- C72 H48 Co10 N12 O55.999 S6 -","6","0.5","","Du, Shaowu; Cui, Meiyan; He, Zhangzhen","A pentanuclear {Co<sub>5</sub>} cluster motif forming a capped breathing kagomé lattice.","Chemical communications (Cambridge, England)","2021","57","54","6616","6619","10.1039/d1cc01987b","","","0.71073","MoKα","","0.0511","0.0507","","","0.1265","0.1268","","","","","","1.248","","","","has coordinates,has disorder","268601","2021-09-06","09:38:15",""
"7128414","8.3202","0.0008","12.3819","0.0008","17.5192","0.0009","81.925","0.005","78.76","0.006","85.352","0.006","1750","0.2","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) diperchlorate acetonitrile solvate","","- C28 H27 Cl2 Fe N13 O10 -","- C28 H27 Cl2 Fe N13 O10 -","- C56 H54 Cl4 Fe2 N26 O20 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0963","0.0875","","","0.252","0.2599","","","","","","1.096","","","","has coordinates,has disorder","267004","2021-07-05","16:14:01",""
"7128415","8.296","0.0002","12.6295","0.0005","18.001","0.0007","84.076","0.003","80.16","0.003","81.045","0.003","1829.95","0.11","250","2","250","2","","","","","","","","8","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) tetrafluoroborate(2/0.9) perchlorate(2/1.1) propionitrile solvate","","- C29 H29 B0.9 Cl1.1 F3.6 Fe N13 O6.4 -","- C29 H29 B0.9 Cl1.1 F3.6 Fe N13 O6.4 -","- C58 H58 B1.8 Cl2.2 F7.2 Fe2 N26 O12.8 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0809","0.0727","","","0.2001","0.2078","","","","","","1.089","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128416","8.2794","0.0003","12.611","0.0005","17.7349","0.0008","82.848","0.004","79.767","0.003","80.613","0.003","1789.15","0.13","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) diperchlorate acetonitrile solvate","","- C28 H27 Cl2 Fe N13 O10 -","- C28 H27 Cl2 Fe N13 O10 -","- C56 H54 Cl4 Fe2 N26 O20 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0633","0.0594","","","0.1523","0.1551","","","","","","1.05","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128417","8.341","0.0003","12.3849","0.0004","17.686","0.0005","82.187","0.003","78.664","0.003","85.14","0.003","1771.57","0.1","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) diperchlorate propionitrile solvate","","- C29 H29 Cl2 Fe N13 O10 -","- C29 H29 Cl2 Fe N13 O10 -","- C58 H58 Cl4 Fe2 N26 O20 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0612","0.0579","","","0.1856","0.1883","","","","","","1.101","","","","has coordinates","267004","2021-07-05","16:14:02",""
"7128418","8.0578","0.00018","12.7729","0.0004","18.7921","0.0006","96.071","0.003","102.311","0.002","101.565","0.002","1828.85","0.1","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) ditetrafluoroborate di-acetonitrile solvate","","- C30 H30 B2 F8 Fe N14 O2 -","- C30 H30 B2 F8 Fe N14 O2 -","- C60 H60 B4 F16 Fe2 N28 O4 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0442","0.0422","","","0.1089","0.1107","","","","","","1.051","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128419","8.2204","0.0005","12.3298","0.001","17.2739","0.0014","82.969","0.007","79.317","0.006","85.481","0.006","1704.7","0.2","125","2","125","2","","","","","","","","7","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) ditetrafluoroborate acetonitrile solvate","","- C28 H27 B2 F8 Fe N13 O2 -","- C28 H27 B2 F8 Fe N13 O2 -","- C56 H54 B4 F16 Fe2 N26 O4 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.1117","0.0862","","","0.2333","0.2517","","","","","","1.048","","","","has coordinates","267004","2021-07-05","16:14:02",""
"7128420","20.7377","0.0003","8.8852","0.0002","19.6895","0.0003","90","","90","","90","","3627.96","0.11","120","2","120","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) ditetrafluoroborate bis-nitromethane solvate","","- C28 H30 B2 F8 Fe N14 O6 -","- C28 H30 B2 F8 Fe N14 O6 -","- C112 H120 B8 F32 Fe4 N56 O24 -","4","0.5","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0408","0.0343","","","0.0838","0.0874","","","","","","1.022","","","","has coordinates","267004","2021-07-05","16:14:02",""
"7128421","8.2454","0.0003","12.6105","0.0006","17.821","0.0009","84.191","0.004","80.215","0.004","81.291","0.004","1799.57","0.14","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) ditetrafluoroborate propionitrile solvate","","- C29 H29 B2 F8 Fe N13 O2 -","- C29 H29 B2 F8 Fe N13 O2 -","- C58 H58 B4 F16 Fe2 N26 O4 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.071","0.0581","","","0.1573","0.1646","","","","","","1.076","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128422","8.3297","0.0004","12.6635","0.0008","18.0861","0.001","83.662","0.005","80.003","0.004","80.933","0.005","1848.56","0.18","240","2","240","2","","","","","","","","6","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) diperchlorate propionitrile solvate","","- C29 H29 Cl2 Fe N13 O10 -","- C29 H29 Cl2 Fe N13 O10 -","- C58 H58 Cl4 Fe2 N26 O20 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.092","0.076","","","0.2052","0.2177","","","","","","1.09","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128423","8.2279","0.0003","12.5396","0.0006","17.5742","0.0011","83.354","0.005","79.986","0.004","80.831","0.004","1755.53","0.16","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) ditetrafluoroborate acetonitrile solvate","","- C28 H27 B2 F8 Fe N13 O2 -","- C28 H27 B2 F8 Fe N13 O2 -","- C56 H54 B4 F16 Fe2 N26 O4 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0771","0.0702","","","0.206","0.2112","","","","","","1.093","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128424","20.7926","0.0004","8.837","0.0003","20.0553","0.0005","90","","90","","90","","3685.05","0.17","120","2","120","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) diperchlorate bis-nitromethane solvate","","- C28 H30 Cl2 Fe N14 O14 -","- C28 H30 Cl2 Fe N14 O14 -","- C112 H120 Cl8 Fe4 N56 O56 -","4","0.5","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0465","0.0383","","","0.0971","0.1036","","","","","","1.03","","","","has coordinates","267004","2021-07-05","16:14:02",""
"7128425","8.3169","0.0003","20.4484","0.0007","22.6673","0.0008","107.978","0.003","99.002","0.003","95.195","0.003","3581.8","0.2","180.15","","180","2","","","","","","","","8","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) tetrafluoroborate(2/0.9) perchlorate(2/1.1) propionitrile solvate","","- C29 H29 B0.9 Cl1.1 F3.6 Fe N13 O6.4 -","- C29 H29 B0.9 Cl1.1 F3.6 Fe N13 O6.4 -","- C116 H116 B3.6 Cl4.4 F14.4 Fe4 N52 O25.6 -","4","2","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.086","0.0676","","","0.1799","0.195","","","","","","1.052","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128426","8.3123","0.0005","12.3617","0.0005","17.5779","0.0006","82.678","0.003","78.686","0.004","85.091","0.004","1753.25","0.14","125","2","125","2","","","","","","","","8","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) tetrafluoroborate(2/0.9) perchlorate(2/1.1) propionitrile solvate","","- C29 H29 B0.9 Cl1.1 F3.6 Fe N13 O6.4 -","- C29 H29 B0.9 Cl1.1 F3.6 Fe N13 O6.4 -","- C58 H58 B1.8 Cl2.2 F7.2 Fe2 N26 O12.8 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0626","0.0495","","","0.1166","0.1245","","","","","","1.029","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128427","8.2085","0.0002","38.9652","0.0011","10.8625","0.0003","90","","105.691","0.003","90","","3344.85","0.16","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) ditetrafluoroborate methanol solvate","","","- C27 H28 B2 F8 Fe N12 O3 -","- C27 H28 B2 F8 Fe N12 O3 -","- C108 H112 B8 F32 Fe4 N48 O12 -","4","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0645","0.0615","","","0.1407","0.1424","","","","","","1.141","","","","has coordinates","267004","2021-07-05","16:14:02",""
"7128428","8.2658","0.0005","12.3645","0.001","17.5585","0.0011","83.555","0.006","79.079","0.005","84.39","0.006","1745.5","0.2","160","2","160","2","","","","","","","","7","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) ditetrafluoroborate propionitrile solvate","","- C29 H29 B2 F8 Fe N13 O2 -","- C29 H29 B2 F8 Fe N13 O2 -","- C58 H58 B4 F16 Fe2 N26 O4 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0836","0.0631","","","0.1595","0.1746","","","","","","1.059","","","","has coordinates","267004","2021-07-05","16:14:02",""
"7128429","8.2123","0.0007","10.9318","0.001","20.008","0.002","79.143","0.009","78.844","0.009","75.48","0.008","1687.4","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) diperchlorate hemi-ethanol solvate","","- C27 H27 Cl2 Fe N12 O10.5 -","- C27 H27 Cl2 Fe N12 O10.5 -","- C54 H54 Cl4 Fe2 N24 O21 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0566","0.0472","","","0.1186","0.1269","","","","","","1.027","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128430","8.2464","0.0003","12.534","0.0009","17.7464","0.0009","83.832","0.005","79.727","0.004","82.425","0.005","1782.48","0.17","187","2","187","2","","","","","","","","7","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) ditetrafluoroborate propionitrile solvate","","- C29 H29 B2 F8 Fe N13 O2 -","- C29 H29 B2 F8 Fe N13 O2 -","- C58 H58 B4 F16 Fe2 N26 O4 -","2","1","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.0783","0.0614","","","0.1619","0.1724","","","","","","1.083","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128431","8.339","0.0002","20.3671","0.0005","22.8144","0.0007","108.029","0.003","98.689","0.002","95.458","0.002","3600.56","0.18","170","2","170","2","","","","","","","","6","P -1","-P 1","2","","Bis-[N-(2,6-di{pyrazol-1-yl}pyrid-4-yl)acetamide]iron(II) diperchlorate propionitrile solvate","","- C29 H29 Cl2 Fe N13 O10 -","- C29 H29 Cl2 Fe N13 O10 -","- C116 H116 Cl8 Fe4 N52 O40 -","4","2","","Berdiell, Izar Capel; Kulmaczewski, Rafal; Shahid, Namrah; Cespedes, Oscar; Halcrow, Malcolm A.","The number and shape of lattice solvent molecules controls spin-crossover in an isomorphous series of crystalline solvate salts.","Chemical communications (Cambridge, England)","2021","57","53","6566","6569","10.1039/d1cc02624k","","x-ray","1.54184","CuKα","","0.096","0.0749","","","0.1991","0.2156","","","","","","1.039","","","","has coordinates,has disorder","267004","2021-07-05","16:14:02",""
"7128432","9.523","0.0007","10.6568","0.0008","10.7489","0.0008","115.937","0.002","108.831","0.002","95.796","0.003","890.09","0.12","200.15","","200.15","","","","","","","","","6","P -1","-P 1","2","","","","- C6 H16 F4 N8 O9 Sb2 -","- C6 H16 F4 N8 O9 Sb2 -","- C12 H32 F8 N16 O18 Sb4 -","2","1","","Chen, Yangxin; Zhu, Tingting; Xiong, Zheyao; Zhou, Yang; Li, Yanqiang; Ding, Qingran; Liu, Youchao; Chen, Xin; Zhao, Sangen; Luo, Junhua","An organic-inorganic hybrid birefringent material with diverse functional groups.","Chemical communications (Cambridge, England)","2021","57","54","6668","6671","10.1039/d1cc02548a","","","0.71073","MoKα","","0.0231","0.0206","","","0.0418","0.0427","","","","","","1.183","","","","has coordinates","268598","2021-09-06","09:37:54",""
"7128433","10.2944","0.0006","12.0674","0.0007","15.9401","0.0008","68.586","0.002","89.702","0.003","78.26","0.003","1799.73","0.18","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H22 F3 N O2 -","- C20 H21.5 F3 N O2 -","- C80 H86 F12 N4 O8 -","4","2","","Xie, Yu-Yang; Wang, Yun-Peng; Zhao, Xiao-Jing; Wang, Ai-Fang; Chen, Zhi-Min; Tu, Yong-Qiang","Oxyallyl cation promoted dearomative semipinacol rearrangement: a facile stereodivergent synthesis of spiro-indolines with contiguous quaternary centers.","Chemical communications (Cambridge, England)","2021","57","54","6632","6635","10.1039/d1cc02033a","","","1.54178","CuKα","","0.1297","0.0924","","","0.2598","0.2891","","","","","","1.634","","","","has coordinates","295543","2024-10-18","15:17:09",""
"7128434","10.432","","10.4321","0.0005","32.8983","0.0016","90","","90","","90","","3580.2","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H22 F3 N O2 -","- C20 H22 F3 N O2 -","- C160 H176 F24 N8 O16 -","8","1","","Xie, Yu-Yang; Wang, Yun-Peng; Zhao, Xiao-Jing; Wang, Ai-Fang; Chen, Zhi-Min; Tu, Yong-Qiang","Oxyallyl cation promoted dearomative semipinacol rearrangement: a facile stereodivergent synthesis of spiro-indolines with contiguous quaternary centers.","Chemical communications (Cambridge, England)","2021","57","54","6632","6635","10.1039/d1cc02033a","","","1.54178","CuKα","","0.0753","0.0663","","","0.1961","0.2081","","","","","","1.065","","","","has coordinates","268599","2021-09-06","09:38:03",""
"7128435","9.2267","0.0007","21.642","0.0017","8.7088","0.0007","90","","112.336","0.002","90","","1608.5","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H23 N O2 -","- C19 H23 N O2 -","- C76 H92 N4 O8 -","4","1","","Xie, Yu-Yang; Wang, Yun-Peng; Zhao, Xiao-Jing; Wang, Ai-Fang; Chen, Zhi-Min; Tu, Yong-Qiang","Oxyallyl cation promoted dearomative semipinacol rearrangement: a facile stereodivergent synthesis of spiro-indolines with contiguous quaternary centers.","Chemical communications (Cambridge, England)","2021","57","54","6632","6635","10.1039/d1cc02033a","","","1.54178","CuKα","","0.0535","0.0511","","","0.145","0.1478","","","","","","1.057","","","","has coordinates","268599","2021-09-06","09:38:03",""
"7128436","6.1119","0.0002","14.5023","0.0005","6.945","0.0002","90","","90.477","0.004","90","","615.56","0.03","296","2","296","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C6 H16 Cl4 Mn N2 -","- C6 H16 Cl4 Mn N2 -","- C12 H32 Cl8 Mn2 N4 -","2","0.5","","Pan, Hong-Mei; Yang, Qian-Lu; Xing, Xin-Xin; Li, Jia-Peng; Meng, Fan-Lei; Zhang, Xin; Xiao, Pan-Chao; Yue, Cheng-Yang; Lei, Xiao-Wu","Enhancement of the photoluminescence efficiency of hybrid manganese halides through rational structural design.","Chemical communications (Cambridge, England)","2021","57","56","6907","6910","10.1039/d1cc02353e","","","1.54184","CuKα","","0.0442","0.0417","","","0.1188","0.1232","","","","","","1.047","","","","has coordinates","268515","2021-09-06","09:04:39",""
"7128437","11.5561","0.0002","9.7596","0.0002","23.9095","0.0005","90","","90","","90","","2696.58","0.09","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H16 Cl4 Mn N2 -","- C6 H16 Cl4 Mn N2 -","- C48 H128 Cl32 Mn8 N16 -","8","1","","Pan, Hong-Mei; Yang, Qian-Lu; Xing, Xin-Xin; Li, Jia-Peng; Meng, Fan-Lei; Zhang, Xin; Xiao, Pan-Chao; Yue, Cheng-Yang; Lei, Xiao-Wu","Enhancement of the photoluminescence efficiency of hybrid manganese halides through rational structural design.","Chemical communications (Cambridge, England)","2021","57","56","6907","6910","10.1039/d1cc02353e","","","1.54184","CuKα","","0.0437","0.039","","","0.1054","0.1194","","","","","","1.007","","","","has coordinates","268515","2021-09-06","09:04:41",""
"7128438","9.996","0.0002","14.3566","0.0002","15.378","0.0003","90","","128.657","0.001","90","","1723.35","0.06","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H23 Cl4 Mn N3 -","- C9 H23 Cl4 Mn N3 -","- C36 H92 Cl16 Mn4 N12 -","4","1","","Pan, Hong-Mei; Yang, Qian-Lu; Xing, Xin-Xin; Li, Jia-Peng; Meng, Fan-Lei; Zhang, Xin; Xiao, Pan-Chao; Yue, Cheng-Yang; Lei, Xiao-Wu","Enhancement of the photoluminescence efficiency of hybrid manganese halides through rational structural design.","Chemical communications (Cambridge, England)","2021","57","56","6907","6910","10.1039/d1cc02353e","","","1.54178","CuKα","","0.0417","0.0351","","","0.0962","0.1083","","","","","","1.042","","","","has coordinates","268515","2021-09-06","09:04:41",""
"7128439","16.387","0.004","15.292","0.004","18.81","0.005","90","","90","","90","","4714","2","296","2","296.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C16 H30 Cl4 Mn N4 -","- C16 H30 Cl4 Mn N4 -","- C128 H240 Cl32 Mn8 N32 -","8","1","","Pan, Hong-Mei; Yang, Qian-Lu; Xing, Xin-Xin; Li, Jia-Peng; Meng, Fan-Lei; Zhang, Xin; Xiao, Pan-Chao; Yue, Cheng-Yang; Lei, Xiao-Wu","Enhancement of the photoluminescence efficiency of hybrid manganese halides through rational structural design.","Chemical communications (Cambridge, England)","2021","57","56","6907","6910","10.1039/d1cc02353e","","","0.71073","MoKα","","0.0602","0.0563","","","0.1634","0.1667","","","","","","1.068","","","","has coordinates,has disorder","268515","2021-09-06","09:04:41",""
"7128440","8.0465","0.0001","15.391","0.0001","16.9396","0.0001","90","","90","","90","","2097.86","0.03","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H28 Cl6 Mn N4 -","- C10 H28 Cl6 Mn N4 -","- C40 H112 Cl24 Mn4 N16 -","4","1","","Pan, Hong-Mei; Yang, Qian-Lu; Xing, Xin-Xin; Li, Jia-Peng; Meng, Fan-Lei; Zhang, Xin; Xiao, Pan-Chao; Yue, Cheng-Yang; Lei, Xiao-Wu","Enhancement of the photoluminescence efficiency of hybrid manganese halides through rational structural design.","Chemical communications (Cambridge, England)","2021","57","56","6907","6910","10.1039/d1cc02353e","","","1.54178","CuKα","","0.026","0.0246","","","0.061","0.0621","","","","","","1.038","","","","has coordinates","268515","2021-09-06","09:04:41",""
"7128441","11.302","0.003","13.079","0.004","17.093","0.005","90","","103.306","0.005","90","","2458.8","1.2","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","[(Cp*)ScMe2]2","","","- C24 H42 Sc2 -","- C24 H42 Sc2 -","- C96 H168 Sc8 -","4","1","","Deng, Peng; Shi, Xianghui; Gong, Xun; Cheng, Jianhua","Trinuclear scandium methylidyne complexes stabilized by pentamethylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","52","6436","6439","10.1039/d1cc01645h","","","0.71073","MoKα","","0.13","0.0629","","","0.1451","0.1768","","","","","","0.968","","","","has coordinates","267011","2021-07-05","16:15:32",""
"7128442","19.234","0.005","19.234","0.005","8.042","0.005","90","0.005","90","0.005","120","0.005","2576.5","1.9","193","2","193","2","","","","","","","","4","R 3 :H","R 3","146","[(Cp*)Sc]3(CH)","","","- C31 H46 Br3 Sc3 -","- C31 H46 Br3 Sc3 -","- C93 H138 Br9 Sc9 -","3","0.333333","","Deng, Peng; Shi, Xianghui; Gong, Xun; Cheng, Jianhua","Trinuclear scandium methylidyne complexes stabilized by pentamethylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","52","6436","6439","10.1039/d1cc01645h","","","0.71073","MoKα","","0.0405","0.0353","","","0.0747","0.0759","","","","","","0.943","","","","has coordinates","267011","2021-07-05","16:15:32",""
"7128443","8.4677","0.0005","11.4252","0.0006","18.6662","0.0009","90.449","0.002","90.296","0.002","100.656","0.002","1774.63","0.16","193","2","193","2","","","","","","","","4","P -1","-P 1","2","[(Cp*)Sc(OMe)]3(CH)","","","- C34 H55 O3 Sc3 -","- C34 H55 O3 Sc3 -","- C68 H110 O6 Sc6 -","2","1","","Deng, Peng; Shi, Xianghui; Gong, Xun; Cheng, Jianhua","Trinuclear scandium methylidyne complexes stabilized by pentamethylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","52","6436","6439","10.1039/d1cc01645h","","","0.71073","MoKα","","0.0692","0.0581","","","0.1595","0.1733","","","","","","1.022","","","","has coordinates","267011","2021-07-05","16:15:32",""
"7128444","11.1532","0.0007","11.2183","0.0007","16.765","0.0009","98.58","0.002","97.778","0.002","110.9","0.002","1896.9","0.2","193","2","193","2","","","","","","","","4","P -1","-P 1","2","[(Cp*)Sc](Br)2(CH)(CH2tBu)","","","- C36 H57 Br2 Sc3 -","- C36 H57 Br2 Sc3 -","- C72 H114 Br4 Sc6 -","2","1","","Deng, Peng; Shi, Xianghui; Gong, Xun; Cheng, Jianhua","Trinuclear scandium methylidyne complexes stabilized by pentamethylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","52","6436","6439","10.1039/d1cc01645h","","","0.71073","MoKα","","0.0581","0.0485","","","0.1274","0.1353","","","","","","1.033","","","","has coordinates,has disorder","267011","2021-07-05","16:15:32",""
"7128445","12.17","0.0006","19.2637","0.0009","19.9851","0.001","63.681","0.002","77.428","0.002","76.109","0.002","4043.3","0.3","193","2","193","2","","","","","","","","5","P -1","-P 1","2","[(Cp*)Sc(OMe)]3(CHCNtBu)","","","- C39 H64 N O3 Sc3 -","- C39 H64 N O3 Sc3 -","- C156 H256 N4 O12 Sc12 -","4","2","","Deng, Peng; Shi, Xianghui; Gong, Xun; Cheng, Jianhua","Trinuclear scandium methylidyne complexes stabilized by pentamethylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","52","6436","6439","10.1039/d1cc01645h","","","0.71073","MoKα","","0.0569","0.0419","","","0.1038","0.1135","","","","","","1.059","","","","has coordinates","295359","2024-10-08","18:26:32",""
"7128446","16.926","0.0015","17.5138","0.0018","18.038","0.0017","67.491","0.003","87.569","0.003","79.633","0.003","4857.1","0.8","193","2","193","2","","","","","","","","5","P -1","-P 1","2","[(Cp*)Sc(OMe)]3[CHC(Ph)N]","","","- C82 H120 N2 O6 Sc6 -","- C82 H120 N2 O6 Sc6 -","- C164 H240 N4 O12 Sc12 -","2","1","","Deng, Peng; Shi, Xianghui; Gong, Xun; Cheng, Jianhua","Trinuclear scandium methylidyne complexes stabilized by pentamethylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","52","6436","6439","10.1039/d1cc01645h","","","0.71073","MoKα","","0.1119","0.0662","","","0.1653","0.1974","","","","","","1.029","","","","has coordinates,has disorder","267011","2021-07-05","16:15:32",""
"7128447","19.1878","0.0009","19.1878","0.0009","15.6298","0.0014","90","","90","","120","","4983.5","0.6","193","2","193","2","","","","","","","","3","R -3 :H","-R 3","148","[(Cp*)ScMe]3(CH)","","","- C34 H55 Sc3 -","- C34 H55 Sc3 -","- C204 H330 Sc18 -","6","0.333333","","Deng, Peng; Shi, Xianghui; Gong, Xun; Cheng, Jianhua","Trinuclear scandium methylidyne complexes stabilized by pentamethylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","52","6436","6439","10.1039/d1cc01645h","","","0.71073","MoKα","","0.047","0.041","","","0.1118","0.1176","","","","","","1.069","","","","has coordinates","267011","2021-07-05","16:15:32",""
"7128448","11.331","0.003","11.495","0.003","18.812","0.005","82.373","0.005","81.188","0.005","65.634","0.004","2199.1","1","193","2","193","2","","","","","","","","3","P -1","-P 1","2","[(Cp*)ScMCH2]4","","","- C44 H68 Sc4 -","- C44 H68 Sc4 -","- C88 H136 Sc8 -","2","1","","Deng, Peng; Shi, Xianghui; Gong, Xun; Cheng, Jianhua","Trinuclear scandium methylidyne complexes stabilized by pentamethylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","52","6436","6439","10.1039/d1cc01645h","","","0.71073","MoKα","","0.1836","0.0855","","","0.1898","0.2414","","","","","","0.979","","","","has coordinates,has disorder","267011","2021-07-05","16:15:32",""
"7128449","8.2125","0.0017","9.891","0.002","11.508","0.003","64.766","0.01","85.376","0.008","74.39","0.01","813.8","0.3","298","2","298.15","","","","","","","","","3","P -1","-P 1","2","CAÂ.DMPÂ.2H2O","(4-Oxo-4H-pyran-2,6-dicarboxylic acid)(2,6-dimethyl-4H-pyran-4-one)2H2O","","- C14 H16 O10 -","- C14 H16 O10 -","- C28 H32 O20 -","2","1","","Li, Changan; Sinnwell, Michael A.; Swenson, Dale C.; MacGillivray, Leonard R.","Cubane-forming cyclic dienes that exhibit orthogonal reactivities in the solid state.","Chemical communications (Cambridge, England)","2021","57","55","6725","6727","10.1039/d1cc02725e","","","0.71073","MoKα","","0.0568","0.0415","","","0.1214","0.1333","","","","","","1.066","","","","has coordinates","268508","2021-09-06","09:03:00",""
"7128450","7.7763","0.0019","8.1868","0.0017","8.683","0.002","82.568","0.007","82.756","0.008","65.804","0.006","498.4","0.2","150","2","150.15","","","","","","","","","3","P -1","-P 1","2","tetraacid cage CG1","6,6,12,12-tetrahydroxy-3,9-dioxapentacyclo[6.4.0.0^2,7.0^4,11.0^5,10]dodecane-2,4,8,10-tetracarboxylic acid hydrate","","- C14.61 H24.61 O19.39 -","- C14.61 H24.61 O19.39 -","- C14.61 H24.61 O19.39 -","1","0.5","","Li, Changan; Sinnwell, Michael A.; Swenson, Dale C.; MacGillivray, Leonard R.","Cubane-forming cyclic dienes that exhibit orthogonal reactivities in the solid state.","Chemical communications (Cambridge, England)","2021","57","55","6725","6727","10.1039/d1cc02725e","","","0.71073","MoKα","","0.1004","0.0605","","","0.122","0.1424","","","","","","1.068","","","","has coordinates,has disorder","268508","2021-09-06","09:03:01",""
"7128451","12.4105","0.0012","7.2547","0.0007","13.7901","0.0014","90","","90","","90","","1241.6","0.2","298.15","","298.15","","","","","","","","","3","C m c e","-C 2ac 2","64","tetramethyl cage","2,4,8,10-tetramethyl-3,9-dioxapentacyclo [6.4.0.0^2,7.0^4,11.0^5,10]dodecane-6,12-dione","","- C14 H16 O4 -","- C14 H16 O4 -","- C56 H64 O16 -","4","0.25","","Li, Changan; Sinnwell, Michael A.; Swenson, Dale C.; MacGillivray, Leonard R.","Cubane-forming cyclic dienes that exhibit orthogonal reactivities in the solid state.","Chemical communications (Cambridge, England)","2021","57","55","6725","6727","10.1039/d1cc02725e","","","0.71073","MoKα","","0.0527","0.0439","","","0.1102","0.1167","","","","","","1.052","","","","has coordinates","268508","2021-09-06","09:03:01",""
"7128452","9.6261","0.001","11.4586","0.0011","11.0733","0.0011","90","","111.621","0.005","90","","1135.5","0.2","150","2","150.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","CAÂ.THF","(4-Oxo-4H-pyran-2,6-dicarboxylic acid)solvate","","- C11 H12 O7 -","- C11 H12 O7 -","- C44 H48 O28 -","4","1","","Li, Changan; Sinnwell, Michael A.; Swenson, Dale C.; MacGillivray, Leonard R.","Cubane-forming cyclic dienes that exhibit orthogonal reactivities in the solid state.","Chemical communications (Cambridge, England)","2021","57","55","6725","6727","10.1039/d1cc02725e","","","0.71073","MoKα","","0.0362","0.0319","","","0.0818","0.0847","","","","","","1.099","","","","has coordinates","268508","2021-09-06","09:03:01",""
"7128453","17.6445","0.0002","25.2002","0.0003","6.8741","0.0001","90","","90","","90","","3056.53","0.07","100","0.1","100","0.1","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C60 H70 N12 O14 Zn3 -","- C60 H70 N12 O14 Zn3 -","- C120 H140 N24 O28 Zn6 -","2","0.5","","Ma, Yu-Juan; Fang, Xiaoyu; Xiao, Guowei; Lu, Bo; Yan, Dongpeng","Triple-mode tunable long-persistent luminescence in a 3D zinc-organic hybrid.","Chemical communications (Cambridge, England)","2021","57","54","6684","6687","10.1039/d1cc02389f","","","1.54178","CuKα","","0.0588","0.0581","","","0.156","0.1568","","","","","","1.039","","","","has coordinates,has disorder","268594","2021-09-06","09:36:28",""
"7128454","26.121","0.003","9.9298","0.001","27.898","0.003","90","","103.715","0.004","90","","7029.8","1.3","100","","99.99","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Fe4N32P8S4C120H240","","- C120 H240 Fe4 N32 P8 S4 -","- C120 H240 Fe4 N32 P8 S4 -","- C240 H480 Fe8 N64 P16 S8 -","2","0.25","","Aguirre Quintana, Luis M.; Yang, Yan; Ramanathan, Arun; Jiang, Ningxin; Bacsa, John; Maron, Laurent; La Pierre, Henry S.","Chalcogen-atom abstraction reactions of a Di-iron imidophosphorane complex.","Chemical communications (Cambridge, England)","2021","57","54","6664","6667","10.1039/d1cc02195h","","x-ray","0.71073","MoKα","","0.0537","0.0377","","","0.0919","0.1033","","","","","","1.039","","","","has coordinates","268595","2021-09-06","09:37:25",""
"7128455","13.069","0.002","13.56","0.002","21.307","0.004","100.59","0.007","95.542","0.007","109.567","0.006","3445.9","1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H120 Fe2 N16 O P4 -","- C60 H120 Fe2 N16 O P4 -","- C120 H240 Fe4 N32 O2 P8 -","2","1","","Aguirre Quintana, Luis M.; Yang, Yan; Ramanathan, Arun; Jiang, Ningxin; Bacsa, John; Maron, Laurent; La Pierre, Henry S.","Chalcogen-atom abstraction reactions of a Di-iron imidophosphorane complex.","Chemical communications (Cambridge, England)","2021","57","54","6664","6667","10.1039/d1cc02195h","","","0.71073","MoKα","","0.0883","0.0558","","","0.1039","0.1199","","","","","","1.028","","","","has coordinates","268595","2021-09-06","09:37:25",""
"7128456","26.073","0.003","9.9415","0.0009","27.859","0.002","90","","103.714","0.003","90","","7015.3","1.1","100","","100","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","C60H120Fe2N16P4Se2","","- C60 H120 Fe2 N16 P4 Se2 -","- C60 H120 Fe2 N16 P4 Se2 -","- C240 H480 Fe8 N64 P16 Se8 -","4","0.5","","Aguirre Quintana, Luis M.; Yang, Yan; Ramanathan, Arun; Jiang, Ningxin; Bacsa, John; Maron, Laurent; La Pierre, Henry S.","Chalcogen-atom abstraction reactions of a Di-iron imidophosphorane complex.","Chemical communications (Cambridge, England)","2021","57","54","6664","6667","10.1039/d1cc02195h","","x-ray","0.71073","MoKα","","0.0925","0.0633","","","0.1532","0.1707","","","","","","1.062","","","","has coordinates","268595","2021-09-06","09:37:25",""
"7128457","15.746","0.002","20.493","0.003","21.46","0.003","95.749","0.006","92.265","0.006","90.151","0.006","6884.4","1.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H120 Co2 N16 P4 -","- C60 H120 Co2 N16 P4 -","- C240 H480 Co8 N64 P16 -","4","2","","Aguirre Quintana, Luis M.; Yang, Yan; Ramanathan, Arun; Jiang, Ningxin; Bacsa, John; Maron, Laurent; La Pierre, Henry S.","Chalcogen-atom abstraction reactions of a Di-iron imidophosphorane complex.","Chemical communications (Cambridge, England)","2021","57","54","6664","6667","10.1039/d1cc02195h","","","0.71073","MoKα","","0.1445","0.1144","","","0.3282","0.3674","","","","","","1.593","","","","has coordinates,has disorder","268595","2021-09-06","09:37:25",""
"7128458","15.746","0.002","20.493","0.003","21.46","0.003","95.749","0.006","92.265","0.006","90.151","0.006","6884.4","1.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H120 Fe2 N16 P4 -","- C60 H120 Fe2 N16 P4 -","- C240 H480 Fe8 N64 P16 -","4","2","","Aguirre Quintana, Luis M.; Yang, Yan; Ramanathan, Arun; Jiang, Ningxin; Bacsa, John; Maron, Laurent; La Pierre, Henry S.","Chalcogen-atom abstraction reactions of a Di-iron imidophosphorane complex.","Chemical communications (Cambridge, England)","2021","57","54","6664","6667","10.1039/d1cc02195h","","","0.71073","MoKα","","0.0641","0.0491","","","0.1147","0.1227","","","","","","1.054","","","","has coordinates,has disorder","268595","2021-09-06","09:37:25",""
"7128459","15.6043","0.0002","10.3677","0.0002","21.3194","0.0005","90","","90","","90","","3449.07","0.11","100.05","0.1","100.05","0.1","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2-pyrenylferrocene","","- C26 H18 Fe -","- C26 H18 Fe -","- C208 H144 Fe8 -","8","1","","Metzelaars, Marvin; Sanz, Sergio; Rawson, Jeff; Hartmann, Rudolf; Schneider, Claus M.; Kögerler, Paul","Fusing pyrene and ferrocene into a chiral, redox-active triangle.","Chemical communications (Cambridge, England)","2021","57","54","6660","6663","10.1039/d1cc02191e","","x-ray","0.71073","MoKα","","0.0776","0.044","","","0.0821","0.0967","","","","","","1.053","","","","has coordinates","268593","2021-09-06","09:36:19",""
"7128460","11.6754","0.0003","16.8491","0.0003","16.8713","0.0003","84.071","0.002","71.467","0.002","83.634","0.002","3119.23","0.12","99.5","1","99.5","1","","","","","","","","3","P -1","-P 1","2","","","","- C92 H64 Fe3 -","- C92 H64 Fe3 -","- C184 H128 Fe6 -","2","1","","Metzelaars, Marvin; Sanz, Sergio; Rawson, Jeff; Hartmann, Rudolf; Schneider, Claus M.; Kögerler, Paul","Fusing pyrene and ferrocene into a chiral, redox-active triangle.","Chemical communications (Cambridge, England)","2021","57","54","6660","6663","10.1039/d1cc02191e","","x-ray","0.71073","MoKα","","0.0579","0.0449","","","0.1163","0.1301","","","","","","1.057","","","","has coordinates","268593","2021-09-06","09:36:19",""
"7128461","20.87","0.0001","11.3826","0.0001","22.1496","0.0001","90","","90","","90","","5261.75","0.06","99.7","0.6","99.7","0.6","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1,1'-Bis(2-pyrenyl)ferrocene","","- C42 H26 Fe -","- C42 H26 Fe -","- C336 H208 Fe8 -","8","1","","Metzelaars, Marvin; Sanz, Sergio; Rawson, Jeff; Hartmann, Rudolf; Schneider, Claus M.; Kögerler, Paul","Fusing pyrene and ferrocene into a chiral, redox-active triangle.","Chemical communications (Cambridge, England)","2021","57","54","6660","6663","10.1039/d1cc02191e","","x-ray","0.71073","MoKα","","0.035","0.0313","","","0.0814","0.0839","","","","","","1.059","","","","has coordinates","268593","2021-09-06","09:36:19",""
"7128462","11.424","0.0003","17.7656","0.0004","18.4462","0.0003","78.866","0.002","79.702","0.002","87.174","0.002","3613.67","0.14","100.3","0.3","100.3","0.3","","","","","","","","4","P -1","-P 1","2","","","","- C98 H88 Fe3 O5 -","- C98 H88 Fe3 O5 -","- C196 H176 Fe6 O10 -","2","1","","Metzelaars, Marvin; Sanz, Sergio; Rawson, Jeff; Hartmann, Rudolf; Schneider, Claus M.; Kögerler, Paul","Fusing pyrene and ferrocene into a chiral, redox-active triangle.","Chemical communications (Cambridge, England)","2021","57","54","6660","6663","10.1039/d1cc02191e","","x-ray","0.71073","MoKα","","0.0929","0.0551","","","0.1143","0.1349","","","","","","1.026","","","","has coordinates,has disorder","268593","2021-09-06","09:36:19",""
"7128463","12.1708","0.0003","12.6323","0.0003","23.6169","0.0005","92.998","0.001","93.518","0.001","115.272","0.001","3264.86","0.13","123","","123","","","","","","","","see text","7","P -1","-P 1","2","","","","- C42 H47 F30 Fe2 N21 O P5 -","- C42 H47 F30 Fe2 N21 O P5 -","- C84 H94 F60 Fe4 N42 O2 P10 -","2","1","","Schlachta, Tim P.; Anneser, Markus R.; Schlagintweit, Jonas F.; Jakob, Christian H. G.; Hintermeier, Carolin; Böth, Alexander D; Haslinger, Stefan; Reich, Robert M.; Kühn, Fritz E","Mimicking reactive high-valent diiron-<i>μ</i><sub>2</sub>-oxo intermediates of nonheme enzymes by an iron tetracarbene complex.","Chemical communications (Cambridge, England)","2021","57","54","6644","6647","10.1039/d1cc02027g","","x-ray","0.71073","MoKα","","0.0558","0.0369","","","0.0795","0.0868","","","","","","1.024","","","","has coordinates,has disorder","268602","2021-09-06","09:38:22",""
"7128464","29.133","0.002","5.3113","0.0003","22.585","0.0013","90","","107.704","0.008","90","","3329.2","0.4","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H18 O3 -","- C22 H18 O3 -","- C176 H144 O24 -","8","1","","Stefkova, Katarina; Heard, Matthew J.; Dasgupta, Ayan; Melen, Rebecca L.","Borane catalysed cyclopropenation of arylacetylenes.","Chemical communications (Cambridge, England)","2021","57","55","6736","6739","10.1039/d1cc01856f","","","1.54184","CuKα","","0.0798","0.0468","","","0.0979","0.1074","","","","","","0.868","","","","has coordinates","268510","2021-09-06","09:03:26",""
"7128465","26.0464","0.0011","18.2137","0.0008","7.6051","0.0004","90","","90","","90","","3607.9","0.3","150","2","150","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C25 H18 O2 -","- C25 H18 O2 -","- C200 H144 O16 -","8","2","","Stefkova, Katarina; Heard, Matthew J.; Dasgupta, Ayan; Melen, Rebecca L.","Borane catalysed cyclopropenation of arylacetylenes.","Chemical communications (Cambridge, England)","2021","57","55","6736","6739","10.1039/d1cc01856f","","","1.54184","CuKα","","0.0804","0.0517","","","0.1171","0.1409","","","","","","1.049","","","","has coordinates","268510","2021-09-06","09:03:26",""
"7128466","14.695","0.003","20.709","0.004","22.202","0.004","79.292","0.004","80.514","0.004","89.184","0.005","6547","2","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C156 H102 O15 S6 -","- C156 H102 O15 S6 -","- C312 H204 O30 S12 -","2","1","","Yubuta, Ayaka; Tsurusaki, Akihiro; Kamikawa, Ken","Transformation from triple helicene to double helicene embedding adjacent stereogenic carbon atoms and axial stereogenicity.","Chemical communications (Cambridge, England)","2021","57","54","6600","6603","10.1039/d1cc02393d","","","0.71075","MoKα","","0.1054","0.0834","","","0.2288","0.2473","","","","","","1.065","","","","has coordinates,has disorder","268596","2021-09-06","09:37:39",""
"7128467","11.523","0.006","12.874","0.007","14.864","0.006","75.48","0.03","75.27","0.03","87.03","0.04","2064.3","1.8","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C53 H36 Cl2 O6 -","- C52.999 H35.998 Cl1.998 O6 -","- C105.998 H71.996 Cl3.996 O12 -","2","1","","Yubuta, Ayaka; Tsurusaki, Akihiro; Kamikawa, Ken","Transformation from triple helicene to double helicene embedding adjacent stereogenic carbon atoms and axial stereogenicity.","Chemical communications (Cambridge, England)","2021","57","54","6600","6603","10.1039/d1cc02393d","","","0.71075","MoKα","","0.1755","0.1047","","","0.2776","0.3464","","","","","","1.039","","","","has coordinates,has disorder","268596","2021-09-06","09:37:39",""
"7128468","11.541","0.004","14.334","0.007","15.473","0.006","94.345","0.016","108.46","0.02","110.631","0.014","2221.1","1.6","103","2","103","2","","","","","","","","3","P -1","-P 1","2","","","","- C59 H54 O7 -","- C59 H54 O7 -","- C118 H108 O14 -","2","1","","Yubuta, Ayaka; Tsurusaki, Akihiro; Kamikawa, Ken","Transformation from triple helicene to double helicene embedding adjacent stereogenic carbon atoms and axial stereogenicity.","Chemical communications (Cambridge, England)","2021","57","54","6600","6603","10.1039/d1cc02393d","","","0.71075","MoKα","","0.099","0.076","","","0.2263","0.2486","","","","","","1.063","","","","has coordinates,has disorder","268596","2021-09-06","09:37:39",""
"7128469","11.493","0.009","13.905","0.01","15.123","0.01","69.85","0.03","68.97","0.02","83.25","0.03","2118","3","103","2","103","2","","","","","","","","3","P -1","-P 1","2","","","","- C51 H34 O5 -","- C51 H34 O5 -","- C102 H68 O10 -","2","1","","Yubuta, Ayaka; Tsurusaki, Akihiro; Kamikawa, Ken","Transformation from triple helicene to double helicene embedding adjacent stereogenic carbon atoms and axial stereogenicity.","Chemical communications (Cambridge, England)","2021","57","54","6600","6603","10.1039/d1cc02393d","","","0.71075","MoKα","","0.1099","0.0627","","","0.1536","0.1881","","","","","","0.905","","","","has coordinates","268596","2021-09-06","09:37:39",""
"7128470","23.9691","0.0005","31.1812","0.0006","19.7005","0.0005","90","","113.624","0.003","90","","13489.9","0.6","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H45 Br4 O4 S4 -","- C40 H45 Br4 O4 S4 -","- C480 H540 Br48 O48 S48 -","12","3","","Yamada, Manabu; Uemure, Fumiya; Katagiri, Hiroshi; Akimoto, Kazuhiko; Hamada, Fumio","Selective separation of branched alkane vapor by thiacalixarene supramolecular crystals having shape-recognition properties.","Chemical communications (Cambridge, England)","2021","57","51","6237","6240","10.1039/d1cc01931g","","","0.71073","MoKα","","0.1031","0.0622","","","0.1512","0.178","","","","","","1.027","","","","has coordinates,has disorder","266995","2021-07-05","16:11:45",""
"7128471","7.377","0.0008","11.8839","0.0013","12.493","0.0017","90.57","0.01","106.868","0.011","100.186","0.009","1029.4","0.2","293.15","","293.15","","","","","","","","","7","P -1","-P 1","2","","","","- C17 H21 Cl F3 N O4 S -","- C17 H21 Cl F3 N O4 S -","- C34 H42 Cl2 F6 N2 O8 S2 -","2","1","","Kodama, Yuki; Imai, Saki; Fujimoto, Junko; Sato, Kohei; Mase, Nobuyuki; Narumi, Tetsuo","Stereoselective synthesis of highly functionalized (<i>Z</i>)-chloroalkene dipeptide isosteres containing an α,α-disubstituted amino acid.","Chemical communications (Cambridge, England)","2021","57","56","6915","6918","10.1039/d1cc02952e","","x-ray","0.71073","MoKα","","0.138","0.0922","","","0.2428","0.275","","","","","","1.02","","","","has coordinates,has disorder","268520","2021-09-06","09:07:02",""
"7128472","7.0093","0.0011","8.9932","0.0009","14.7723","0.0015","93.204","0.008","99.536","0.01","96.869","0.01","909","0.2","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C15 H24 Cl N O4 S -","- C15 H24 Cl N O4 S -","- C30 H48 Cl2 N2 O8 S2 -","2","1","","Kodama, Yuki; Imai, Saki; Fujimoto, Junko; Sato, Kohei; Mase, Nobuyuki; Narumi, Tetsuo","Stereoselective synthesis of highly functionalized (<i>Z</i>)-chloroalkene dipeptide isosteres containing an α,α-disubstituted amino acid.","Chemical communications (Cambridge, England)","2021","57","56","6915","6918","10.1039/d1cc02952e","","x-ray","0.71073","MoKα","","0.0764","0.0568","","","0.1324","0.1423","","","","","","1.132","","","","has coordinates,has disorder","268520","2021-09-06","09:07:02",""
"7128473","12.396","0.004","14.044","0.004","11.92","0.003","90","","118.17","0.04","90","","1829.3","1.1","293.15","","293.15","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 Br Cl2 N O4 S -","- C14 H18 Br Cl2 N O4 S -","- C56 H72 Br4 Cl8 N4 O16 S4 -","4","1","","Kodama, Yuki; Imai, Saki; Fujimoto, Junko; Sato, Kohei; Mase, Nobuyuki; Narumi, Tetsuo","Stereoselective synthesis of highly functionalized (<i>Z</i>)-chloroalkene dipeptide isosteres containing an α,α-disubstituted amino acid.","Chemical communications (Cambridge, England)","2021","57","56","6915","6918","10.1039/d1cc02952e","","","0.71073","MoKα","","0.1256","0.0527","","","0.096","0.1205","","","","","","1.026","","","","has coordinates,has disorder","268520","2021-09-06","09:07:02",""
"7128474","6.5794","0.0009","8.0509","0.0019","33.122","0.006","90","","90.055","0.014","90","","1754.5","0.6","293.15","","293.15","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H17 Br Cl N O4 S -","- C14 H17 Br Cl N O4 S -","- C56 H68 Br4 Cl4 N4 O16 S4 -","4","1","","Kodama, Yuki; Imai, Saki; Fujimoto, Junko; Sato, Kohei; Mase, Nobuyuki; Narumi, Tetsuo","Stereoselective synthesis of highly functionalized (<i>Z</i>)-chloroalkene dipeptide isosteres containing an α,α-disubstituted amino acid.","Chemical communications (Cambridge, England)","2021","57","56","6915","6918","10.1039/d1cc02952e","","x-ray","0.71073","MoKα","","0.1033","0.0857","","","0.2062","0.2216","","","","","","1.052","","","","has coordinates","268520","2021-09-06","09:07:02",""
"7128475","14.1676","0.0019","21.601","0.003","23.423","0.004","90","","94.248","0.013","90","","7148.5","1.8","293","","293","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C32 H60 Cl N2 O4 S -","- C32 H60 Cl N2 O4 S -","- C256 H480 Cl8 N16 O32 S8 -","8","1","","Kodama, Yuki; Imai, Saki; Fujimoto, Junko; Sato, Kohei; Mase, Nobuyuki; Narumi, Tetsuo","Stereoselective synthesis of highly functionalized (<i>Z</i>)-chloroalkene dipeptide isosteres containing an α,α-disubstituted amino acid.","Chemical communications (Cambridge, England)","2021","57","56","6915","6918","10.1039/d1cc02952e","","x-ray","0.71073","MoKα","","0.1362","0.0619","","","0.1515","0.1905","","","","","","1.017","","","","has coordinates,has disorder","268520","2021-09-06","09:07:02",""
"7128476","11.919","0.0005","9.6321","0.0003","7.8264","0.0002","90","","117.547","0.003","90","","796.65","0.05","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Cd Cl2 Cu2 O6 Se2 -","- Cd Cl2 Cu2 O6 Se2 -","- Cd4 Cl8 Cu8 O24 Se8 -","4","0.5","","Zhang, Mengsi; Cui, Meiyan; Zhao, Zhiying; Huang, Xing; He, Zhangzhen","A spin-1/2 gapped compound CdCu<sub>2</sub>(SeO<sub>3</sub>)<sub>2</sub>Cl<sub>2</sub> with a ladder structure.","Chemical communications (Cambridge, England)","2021","57","56","6923","6926","10.1039/d1cc02243a","","x-ray","0.71073","MoKα","","0.0205","0.0191","","","0.0476","0.0481","","","","","","1.179","","","","has coordinates","268516","2021-09-06","09:04:48",""
"7128477","9.5268","0.0003","25.088","0.0008","8.4177","0.0003","90","","111.28","0.002","90","","1874.73","0.11","215","2","215","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N5 O4 -","- C20 H21 N5 O4 -","- C80 H84 N20 O16 -","4","1","","Lei, Xiaofang; Lampiri, Panagiota; Patil, Pravin; Angeli, Giasemi; Neochoritis, Constantinos G.; Dömling, Alexander","A multicomponent tetrazolo indole synthesis.","Chemical communications (Cambridge, England)","2021","57","54","6652","6655","10.1039/d1cc02384e","","","1.54178","CuKα","","0.0822","0.0656","","","0.1793","0.1934","","","","","","1.435","","","","has coordinates","268591","2021-09-06","09:35:40",""
"7128478","25.8464","0.0008","5.1215","0.0001","20.1569","0.0014","90","","126.721","0.009","90","","2138.7","0.3","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H10 Ba2 N2 O15 -","- C12 H14 Ba2 N2 O15 -","- C48 H56 Ba8 N8 O60 -","4","0.5","","Ben Uliel, Tal; Farber, Eliyahu M.; Aviv, Hagit; Stroek, Wowa; Farbinteanu, Marilena; Tischler, Yaakov R.; Eisenberg, David","Combining polarized low-frequency Raman with XRD to identify directional structural motifs in a pyrolysis precursor.","Chemical communications (Cambridge, England)","2021","57","57","7015","7018","10.1039/d1cc00420d","","","0.71075","MoKα","","0.0195","0.0173","","","0.0476","0.0628","","","","","","1.232","","","","has coordinates","268543","2021-09-06","09:11:59",""
"7128479","7.264","0.0004","9.152","0.0004","14.573","0.0009","99.936","0.003","100.163","0.003","110.8","0.003","861.85","0.09","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Eisenberg2 (Eliyahu)","","","- C10 H22 Ba N2 O12 -","- C10 H22 Ba N2 O12 -","- C20 H44 Ba2 N4 O24 -","2","1","","Ben Uliel, Tal; Farber, Eliyahu M.; Aviv, Hagit; Stroek, Wowa; Farbinteanu, Marilena; Tischler, Yaakov R.; Eisenberg, David","Combining polarized low-frequency Raman with XRD to identify directional structural motifs in a pyrolysis precursor.","Chemical communications (Cambridge, England)","2021","57","57","7015","7018","10.1039/d1cc00420d","","","0.71073","MoKα","","0.0244","0.0234","","","0.0574","0.0579","","","","","","1.062","","","","has coordinates","268543","2021-09-06","09:12:01",""
"7128480","13.899","0.005","8.475","0.003","13.313","0.005","90","","95.606","0.008","90","","1560.7","1","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Eisenberg3b (Eliyahu)","","","- C10 H20 N2 O11 Sr -","- C10 H20 N2 O11 Sr -","- C40 H80 N8 O44 Sr4 -","4","1","","Ben Uliel, Tal; Farber, Eliyahu M.; Aviv, Hagit; Stroek, Wowa; Farbinteanu, Marilena; Tischler, Yaakov R.; Eisenberg, David","Combining polarized low-frequency Raman with XRD to identify directional structural motifs in a pyrolysis precursor.","Chemical communications (Cambridge, England)","2021","57","57","7015","7018","10.1039/d1cc00420d","","","0.71073","MoKα","","0.046","0.0305","","","0.0625","0.0664","","","","","","0.983","","","","has coordinates","268543","2021-09-06","09:12:04",""
"7128481","14.2829","0.0006","14.2829","0.0006","5.2532","0.0003","90","","90","","120","","928.08","0.08","273","2","273","2","","","","","","","","3","P -3","-P 3","147","","","","- C42 H24 O12 -","- C42 H24 O12 -","- C42 H24 O12 -","1","0.166667","","Hirohata, Tomoki; Shida, Naoki; Uekusa, Hidehiro; Yasuda, Nobuhiro; Nishihara, Hirotomo; Ogoshi, Tomoki; Tomita, Ikuyoshi; Inagi, Shinsuke","Pillar[6]quinone: facile synthesis, crystal structures and electrochemical properties.","Chemical communications (Cambridge, England)","2021","57","52","6360","6363","10.1039/d1cc02413b","","","0.81078","Synchrotron","","0.1055","0.0864","","","0.2377","0.2585","","","","","","1.076","","","","has coordinates","267013","2021-07-05","16:15:45",""
"7128482","9.0808","0.0012","10.5099","0.0014","11.796","0.0016","90","","90","","90","","1125.8","0.3","93","2","93","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H12 Cl N O3 -","- C11 H12 Cl N O3 -","- C44 H48 Cl4 N4 O12 -","4","1","","Toda, Yasunori; Shishido, Minoru; Aoki, Tatsuya; Sukegawa, Kimiya; Suga, Hiroyuki","Switchable synthesis of cyclic carbamates by carbon dioxide fixation at atmospheric pressure.","Chemical communications (Cambridge, England)","2021","57","54","6672","6675","10.1039/d1cc02493k","","","0.71073","MoKα","","0.1527","0.0508","","","0.0754","0.1002","","","","","","0.982","","","","has coordinates","268600","2021-09-06","09:38:09",""
"7128483","6.554","0.0003","16.2084","0.0007","16.8478","0.0008","90","","90","","90","","1789.74","0.14","280","2","280.63","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H24 O2 -","- C21 H24 O2 -","- C84 H96 O8 -","4","1","","Dai, Zhen-Yao; Wang, Pu-Sheng; Gong, Liu-Zhu","Access to chiral γ-butenolides via palladium-catalyzed asymmetric allylic C-H alkylation of 1,4-dienes.","Chemical communications (Cambridge, England)","2021","57","55","6748","6751","10.1039/d1cc02295d","","","1.34139","GaKα","","0.0731","0.045","","","0.0994","0.1141","","","","","","1.128","","","","has coordinates","268507","2021-09-06","09:02:52",""
"7128484","13.518","0.0007","8.3701","0.0004","19.8041","0.0011","90","","101.284","0.003","90","","2197.5","0.2","170","2","169.98","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C49 H34 F12 N3 O6 P -","- C49 H34 F12 N3 O6 P -","- C98 H68 F24 N6 O12 P2 -","2","1","","Dai, Zhen-Yao; Wang, Pu-Sheng; Gong, Liu-Zhu","Access to chiral γ-butenolides via palladium-catalyzed asymmetric allylic C-H alkylation of 1,4-dienes.","Chemical communications (Cambridge, England)","2021","57","55","6748","6751","10.1039/d1cc02295d","","","1.34139","GaKα","","0.0905","0.0638","","","0.1576","0.1775","","","","","","1.16","","","","has coordinates","268507","2021-09-06","09:02:53",""
"7128485","11.6525","0.0006","13.4838","0.0007","13.7533","0.0007","92.055","0.002","103.119","0.002","111.67","0.002","1938.61","0.18","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H32 Cl2 F12 Fe N14 P2 -","- C26 H30 F12 Fe N14 P2 -","- C52 H60 F24 Fe2 N28 P4 -","2","1","","Dierks, Philipp; Kruse, Ayla; Bokareva, Olga S.; Al-Marri, Mohammed J; Kalmbach, Jens; Baltrun, Marc; Neuba, Adam; Schoch, Roland; Hohloch, Stephan; Heinze, Katja; Seitz, Michael; Kühn, Oliver; Lochbrunner, Stefan; Bauer, Matthias","Distinct photodynamics of κ-N and κ-C pseudoisomeric iron(II) complexes.","Chemical communications (Cambridge, England)","2021","57","54","6640","6643","10.1039/d1cc01716k","","","0.71073","MoKα","","0.0352","0.031","","","0.0797","0.0837","","","","","","1.038","","","","has coordinates","268592","2021-09-06","09:35:50",""
"7128486","8.5217","0.0014","36.898","0.006","13.416","0.002","90","","94.519","0.003","90","","4205.3","1.2","130","2","130","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H40 Cl2 F12 Fe N14 P2 -","- C30 H38 F12 Fe N14 P2 -","- C120 H152 F48 Fe4 N56 P8 -","4","1","","Dierks, Philipp; Kruse, Ayla; Bokareva, Olga S.; Al-Marri, Mohammed J; Kalmbach, Jens; Baltrun, Marc; Neuba, Adam; Schoch, Roland; Hohloch, Stephan; Heinze, Katja; Seitz, Michael; Kühn, Oliver; Lochbrunner, Stefan; Bauer, Matthias","Distinct photodynamics of κ-N and κ-C pseudoisomeric iron(II) complexes.","Chemical communications (Cambridge, England)","2021","57","54","6640","6643","10.1039/d1cc01716k","","","0.71073","MoKα","","0.0981","0.0591","","","0.1354","0.1457","","","","","","0.954","","","","has coordinates,has disorder","268592","2021-09-06","09:35:54",""
"7128487","35.039","0.003","35.039","0.003","35.039","0.003","90","","90","","90","","43018","6","175","2","175","2","","","","","","","","6","I -4 3 d","I -4bd 2c 3","220","","","","- C54 H73 Eu4 N4 O34 Zn6 -","- C54.0002 H73.0002 Eu4 N4 O34 Zn6 -","- C864.003 H1168 Eu64 N64 O544 Zn96 -","16","0.333333","","Ge, Rui; Liu, Jin-Hua; Li, Xin-Hao; Li, Ling-Yun; Sun, Yan-Qiong; Li, Zhikai; Li, Xin-Xiong; Zheng, Shou-Tian","Luminescent cluster-organic frameworks constructed from predesigned supertetrahedral {Ln<sub>4</sub>Zn<sub>6</sub>} secondary building units.","Chemical communications (Cambridge, England)","2021","57","56","6927","6930","10.1039/d1cc02727a","","","0.71073","MoKα","","0.0702","0.045","","","0.0991","0.1097","","","","","","1.074","","","","has coordinates","268518","2021-09-06","09:06:09",""
"7128488","13.8705","0.0003","13.8705","0.0003","22.5752","0.0008","90","","90","","90","","4343.3","0.2","175","2","175","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C60 H86 Eu4 N12 O43 Zn6 -","- C60 H86 Eu4 N12 O43 Zn6 -","- C120 H172 Eu8 N24 O86 Zn12 -","2","0.25","","Ge, Rui; Liu, Jin-Hua; Li, Xin-Hao; Li, Ling-Yun; Sun, Yan-Qiong; Li, Zhikai; Li, Xin-Xiong; Zheng, Shou-Tian","Luminescent cluster-organic frameworks constructed from predesigned supertetrahedral {Ln<sub>4</sub>Zn<sub>6</sub>} secondary building units.","Chemical communications (Cambridge, England)","2021","57","56","6927","6930","10.1039/d1cc02727a","","","0.71073","MoKα","","0.0469","0.0397","","","0.1029","0.1081","","","","","","1.073","","","","has coordinates","268518","2021-09-06","09:06:19",""
"7128489","7.68636","0.00012","17.1382","0.0003","18.5598","0.0003","90","","100.965","0.0017","90","","2400.25","0.07","108.85","0.1","108.85","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H32 Cl N3 O Ru -","- C25 H32 Cl N3 O Ru -","- C100 H128 Cl4 N12 O4 Ru4 -","4","1","","Zhang, Bo; Duan, Yu'ai; Zhang, Xin; Guo, Shuai","Uncommon carbene-to-azole ligand rearrangement of N-heterocyclic carbenes in a ruthenium system.","Chemical communications (Cambridge, England)","2021","57","56","6879","6882","10.1039/d1cc01871j","","x-ray","0.71073","MoKα","","0.0272","0.0229","","","0.0536","0.0561","","","","","","1.059","","","","has coordinates","268519","2021-09-06","09:06:47",""
"7128490","9.7938","0.0002","13.4269","0.0002","14.9677","0.0002","66.924","0.001","77.554","0.002","79.592","0.001","1758.05","0.05","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C41 H48 Cl N3 Ru -","- C41 H48 Cl N3 Ru -","- C82 H96 Cl2 N6 Ru2 -","2","1","","Zhang, Bo; Duan, Yu'ai; Zhang, Xin; Guo, Shuai","Uncommon carbene-to-azole ligand rearrangement of N-heterocyclic carbenes in a ruthenium system.","Chemical communications (Cambridge, England)","2021","57","56","6879","6882","10.1039/d1cc01871j","","x-ray","1.54184","CuKα","","0.0344","0.029","","","0.0743","0.0768","","","","","","1.061","","","","has coordinates,has disorder","268519","2021-09-06","09:06:48",""
"7128491","9.2936","0.0002","13.2026","0.0003","15.1517","0.0003","70.654","0.002","83.062","0.002","74.253","0.002","1687.32","0.07","294.7","0.4","294.7","0.4","","","","","","","","6","P -1","-P 1","2","","","","- C33 H44 Cl N3 O4 Ru -","- C33 H44 Cl N3 O4 Ru -","- C66 H88 Cl2 N6 O8 Ru2 -","2","1","","Zhang, Bo; Duan, Yu'ai; Zhang, Xin; Guo, Shuai","Uncommon carbene-to-azole ligand rearrangement of N-heterocyclic carbenes in a ruthenium system.","Chemical communications (Cambridge, England)","2021","57","56","6879","6882","10.1039/d1cc01871j","","x-ray","0.71073","MoKα","","0.0396","0.0326","","","0.0837","0.0869","","","","","","1.055","","","","has coordinates,has disorder","268519","2021-09-06","09:06:48",""
"7128492","15.6278","0.0002","19.7257","0.0002","26.6898","0.0002","87.216","0.001","76.249","0.001","88.133","0.001","7980.52","0.15","99.98","0.1","99.98","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C43 H51 Cl3 N3 O Ru -","- C43 H51 Cl3 N3 O Ru -","- C344 H408 Cl24 N24 O8 Ru8 -","8","4","","Zhang, Bo; Duan, Yu'ai; Zhang, Xin; Guo, Shuai","Uncommon carbene-to-azole ligand rearrangement of N-heterocyclic carbenes in a ruthenium system.","Chemical communications (Cambridge, England)","2021","57","56","6879","6882","10.1039/d1cc01871j","","x-ray","1.54184","CuKα","","0.0704","0.0541","","","0.1518","0.1688","","","","","","1.05","","","","has coordinates,has disorder","268519","2021-09-06","09:06:48",""
"7128493","22.3564","0.0008","14.7681","0.0006","19.7942","0.0007","90","","99.722","0.001","90","","6441.4","0.4","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C37 H40 Cl N3 Ru -","- C37 H40 Cl N3 Ru -","- C296 H320 Cl8 N24 Ru8 -","8","1","","Zhang, Bo; Duan, Yu'ai; Zhang, Xin; Guo, Shuai","Uncommon carbene-to-azole ligand rearrangement of N-heterocyclic carbenes in a ruthenium system.","Chemical communications (Cambridge, England)","2021","57","56","6879","6882","10.1039/d1cc01871j","","","0.71073","MoKα","","0.0242","0.0218","","","0.0513","0.0528","","","","","","1.055","","","","has coordinates","268519","2021-09-06","09:06:48",""
"7128494","9.8113","0.0002","12.0833","0.0004","12.1527","0.0003","82.005","0.002","82.769","0.002","71.726","0.003","1349.59","0.07","123","","123","","","","","","","","","4","P -1","-P 1","2","","","","- C34 H32 N2 Si -","- C34 H32 N2 Si -","- C68 H64 N4 Si2 -","2","1","","Dong, Yafang; Sekine, Kohei; Kuninobu, Yoichiro","Facile synthesis of tribenzosilepins from terphenyls and dihydrosilanes by electrophilic double silylation.","Chemical communications (Cambridge, England)","2021","57","57","7007","7010","10.1039/d1cc02326h","","x-ray","0.71073","MoKα","","0.0386","0.0353","","","0.0929","0.095","","","","","","1.046","","","","has coordinates","268541","2021-09-06","09:11:30",""
"7128495","15.3334","0.0008","11.1613","0.0008","15.7358","0.0009","90","","91.89","0.005","90","","2691.6","0.3","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C62 H58 N4 Si2 -","- C2.48 H2.32 N0.16 Si0.08 -","- C124 H116 N8 Si4 -","50","12.5","","Dong, Yafang; Sekine, Kohei; Kuninobu, Yoichiro","Facile synthesis of tribenzosilepins from terphenyls and dihydrosilanes by electrophilic double silylation.","Chemical communications (Cambridge, England)","2021","57","57","7007","7010","10.1039/d1cc02326h","","x-ray","0.71073","MoKα","","0.0791","0.0615","","","0.1631","0.172","","","","","","1.052","","","","has coordinates,has disorder","268541","2021-09-06","09:11:33",""
"7128496","9.192","0.0003","20.3292","0.0006","20.1781","0.0005","90","","90.337","0.002","90","","3770.54","0.19","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H42 N2 O2 Si -","- C48 H42 N2 O2 Si -","- C192 H168 N8 O8 Si4 -","4","1","","Dong, Yafang; Sekine, Kohei; Kuninobu, Yoichiro","Facile synthesis of tribenzosilepins from terphenyls and dihydrosilanes by electrophilic double silylation.","Chemical communications (Cambridge, England)","2021","57","57","7007","7010","10.1039/d1cc02326h","","x-ray","0.71073","MoKα","","0.047","0.0389","","","0.0998","0.1042","","","","","","1.051","","","","has coordinates","268541","2021-09-06","09:11:35",""
"7128501","4.9825","0.0007","9.7519","0.0012","6.9741","0.001","90","","93.55","0.012","90","","338.21","0.08","99.97","0.17","99.97","0.17","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- Ga2 H2 O9 S Te -","- Ga2 H2 O9 S Te -","- Ga4 H4 O18 S2 Te2 -","2","0.5","","Li, Peng-Fei; Hu, Chun-Li; Gong, Ya-Ping; Kong, Fang; Mao, Jiang-Gao","Hg<sub>3</sub>(Te<sub>3</sub>O<sub>8</sub>)(SO<sub>4</sub>): a new sulfate tellurite with a novel structure and large birefringence explored from d<sup>10</sup> metal compounds.","Chemical communications (Cambridge, England)","2021","57","57","7039","7042","10.1039/d1cc02494a","","","0.71073","MoKα","","0.0448","0.0345","","","0.071","0.0782","","","","","","1.056","","","","has coordinates","268540","2021-09-06","09:11:11",""
"7128502","22.8452","0.0016","5.4594","0.0003","15.6547","0.0013","90","","99.598","0.007","90","","1925.1","0.2","290.55","0.1","290.55","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- H2 O23 S2 Te6 Zn4 -","- H2 O23 S2 Te6 Zn4 -","- H8 O92 S8 Te24 Zn16 -","4","0.5","","Li, Peng-Fei; Hu, Chun-Li; Gong, Ya-Ping; Kong, Fang; Mao, Jiang-Gao","Hg<sub>3</sub>(Te<sub>3</sub>O<sub>8</sub>)(SO<sub>4</sub>): a new sulfate tellurite with a novel structure and large birefringence explored from d<sup>10</sup> metal compounds.","Chemical communications (Cambridge, England)","2021","57","57","7039","7042","10.1039/d1cc02494a","","","0.71073","MoKα","","0.0311","0.0289","","","0.0659","0.0672","","","","","","1.093","","","","has coordinates","268540","2021-09-06","09:11:11",""
"7128503","17.6356","0.0014","6.7576","0.0004","16.455","0.0012","90","","107.394","0.008","90","","1871.3","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- H2 In2 O11 S Te2 -","- H2 In2 O11 S Te2 -","- H16 In16 O88 S8 Te16 -","8","1","","Li, Peng-Fei; Hu, Chun-Li; Gong, Ya-Ping; Kong, Fang; Mao, Jiang-Gao","Hg<sub>3</sub>(Te<sub>3</sub>O<sub>8</sub>)(SO<sub>4</sub>): a new sulfate tellurite with a novel structure and large birefringence explored from d<sup>10</sup> metal compounds.","Chemical communications (Cambridge, England)","2021","57","57","7039","7042","10.1039/d1cc02494a","","","0.71073","MoKα","","0.0289","0.0246","","","0.0567","0.0598","","","","","","0.992","","","","has coordinates","268540","2021-09-06","09:11:11",""
"7128504","6.4986","0.0006","9.7848","0.0009","10.7128","0.001","67.178","0.009","72.622","0.009","73.471","0.008","588.1","0.1","290.62","0.1","290.62","0.1","","","","","","","","4","P -1","-P 1","2","","","","- Hg3 O12 S Te3 -","- Hg3 O12 S Te3 -","- Hg6 O24 S2 Te6 -","2","1","","Li, Peng-Fei; Hu, Chun-Li; Gong, Ya-Ping; Kong, Fang; Mao, Jiang-Gao","Hg<sub>3</sub>(Te<sub>3</sub>O<sub>8</sub>)(SO<sub>4</sub>): a new sulfate tellurite with a novel structure and large birefringence explored from d<sup>10</sup> metal compounds.","Chemical communications (Cambridge, England)","2021","57","57","7039","7042","10.1039/d1cc02494a","","","0.71073","MoKα","","0.0497","0.0398","","","0.0889","0.0958","","","","","","1.059","","","","has coordinates","268540","2021-09-06","09:11:11",""
"7128505","11.47","0.0004","23.4314","0.0008","7.3958","0.0003","90","","90","","90","","1987.68","0.13","298","2","298","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C16 H25 N2 O8 P -","- C16 H25 N2 O8 P -","- C64 H100 N8 O32 P4 -","4","1","","Altenhofer, Erich F.; Lawler, Michael J.; Kumar, Pankaj; Joyce, Leo A.; Fowler-Watters, Matthew; Pei, Tao; Li, Zhen","Synthesis of a novel cyclopropyl phosphonate nucleotide as a phosphate mimic.","Chemical communications (Cambridge, England)","2021","57","55","6808","6811","10.1039/d1cc02328d","","","1.54178","CuKα","","0.0632","0.0617","","","0.1638","0.1661","","","","","","1.052","","","","has coordinates,has disorder","268512","2021-09-06","09:03:42",""
"7128507","47.954","0.002","47.954","0.002","13.5821","0.001","90","","90","","120","","27049","3","90","","90","","","","","","","","","4","R -3 :H","-R 3","148","","","","- C51.37 H64.89 N O6.63 -","- C51.369 H64.886 N O6.633 -","- C924.642 H1167.95 N18 O119.394 -","18","1","","Sugiura, Shinya; Maeda, Hiromitsu","Pyrrole-bridged quinones: π-electronic systems that modulate electronic structures by tautomerism and deprotonation.","Chemical communications (Cambridge, England)","2021","57","57","6983","6986","10.1039/d1cc02691g","","","0.71073","MoKα","","0.145","0.1069","","","0.2897","0.3237","","","","","","1.035","","","","has coordinates,has disorder","268544","2021-09-06","09:12:29",""
"7128508","11.902","0.003","13.335","0.003","18.233","0.004","80.776","0.007","82.656","0.009","70.927","0.008","2690.7","1.1","90","","90","","","","","","","","","4","P -1","-P 1","2","","","","- C59 H84 N2 O3 -","- C56 H78 N2 O2 -","- C112 H156 N4 O4 -","2","1","","Sugiura, Shinya; Maeda, Hiromitsu","Pyrrole-bridged quinones: π-electronic systems that modulate electronic structures by tautomerism and deprotonation.","Chemical communications (Cambridge, England)","2021","57","57","6983","6986","10.1039/d1cc02691g","","","0.71073","MoKα","","0.1233","0.0901","","","0.2354","0.2583","","","","","","1.05","","","","has coordinates","268544","2021-09-06","09:12:31",""
"7128509","13.569","0.003","10.997","0.002","28.205","0.005","90","","102.296","0.006","90","","4112.2","1.4","90","","90","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C41 H66 N O3 -","- C41 H66 N O3 -","- C164 H264 N4 O12 -","4","1","","Sugiura, Shinya; Maeda, Hiromitsu","Pyrrole-bridged quinones: π-electronic systems that modulate electronic structures by tautomerism and deprotonation.","Chemical communications (Cambridge, England)","2021","57","57","6983","6986","10.1039/d1cc02691g","","","0.71073","MoKα","","0.1653","0.1186","","","0.2448","0.2646","","","","","","1.166","","","","has coordinates","268544","2021-09-06","09:12:34",""
"7128510","13.767","0.002","9.1739","0.0016","29.862","0.005","90","","92.477","0.006","90","","3768","1.1","90","","90","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C44 H53 N O3 -","- C44 H53 N O3 -","- C176 H212 N4 O12 -","4","1","","Sugiura, Shinya; Maeda, Hiromitsu","Pyrrole-bridged quinones: π-electronic systems that modulate electronic structures by tautomerism and deprotonation.","Chemical communications (Cambridge, England)","2021","57","57","6983","6986","10.1039/d1cc02691g","","","0.71073","MoKα","","0.1551","0.1054","","","0.258","0.2961","","","","","","1.028","","","","has coordinates","268544","2021-09-06","09:12:36",""
"7128511","15.404","0.002","15.899","0.002","17.995","0.002","90","","90","","90","","4407.1","0.9","90","","90","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C44 H68 Br2 N2 O2 -","- C44 H68 Br2 N2 O2 -","- C176 H272 Br8 N8 O8 -","4","1","","Sugiura, Shinya; Maeda, Hiromitsu","Pyrrole-bridged quinones: π-electronic systems that modulate electronic structures by tautomerism and deprotonation.","Chemical communications (Cambridge, England)","2021","57","57","6983","6986","10.1039/d1cc02691g","","","0.71073","MoKα","","0.0731","0.0547","","","0.1223","0.1307","","","","","","1.025","","","","has coordinates","268544","2021-09-06","09:12:36",""
"7128512","10.1504","0.0004","10.2597","0.0004","26.1604","0.001","84.653","0.003","87.864","0.003","75.323","0.003","2623.72","0.18","290","2","290","2","","","","","","","","3","P -1","-P 1","2","","","","- C77 H14 O3 -","- C77 H14 O3 -","- C154 H28 O6 -","2","1","","Lu, Wen-Qiang; Zhou, Dian-Bing; Yin, Zheng-Chun; Liu, Qing-Song; Wang, Guan-Wu","A copper-promoted synthesis of epoxy-bridged [60]fullerene-fused lactones and further derivatization.","Chemical communications (Cambridge, England)","2021","57","57","7043","7046","10.1039/d1cc02669k","","","1.54184","CuKα","","0.09","0.074","","","0.2093","0.2204","","","","","","0.997","","","","has coordinates","268545","2021-09-06","09:12:46",""
"7128513","12.4956","0.00018","21.1248","0.0005","16.7633","0.0003","90","","90","","90","","4424.96","0.15","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C77 H13 O2 S4 -","- C77 H13 O2 S4 -","- C308 H52 O8 S16 -","4","0.5","","Lu, Wen-Qiang; Zhou, Dian-Bing; Yin, Zheng-Chun; Liu, Qing-Song; Wang, Guan-Wu","A copper-promoted synthesis of epoxy-bridged [60]fullerene-fused lactones and further derivatization.","Chemical communications (Cambridge, England)","2021","57","57","7043","7046","10.1039/d1cc02669k","","x-ray","1.54184","CuKα","","0.0748","0.0659","","","0.1622","0.1692","","","","","","1.086","","","","has coordinates","268545","2021-09-06","09:12:46",""
"7128514","17.0004","0.0004","11.7535","0.0003","7.8717","0.0002","90","","102.624","0.001","90","","1534.85","0.07","170","2","170","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 N O4 S2 -","- C15 H15 N O4 S2 -","- C60 H60 N4 O16 S8 -","4","1","","Zeng, Linwei; Jin, Jian; He, Jixiao; Cui, Sunliang","Photo-induced synthesis of β-sulfonyl imides from carboxylic acids.","Chemical communications (Cambridge, England)","2021","57","55","6792","6795","10.1039/d1cc02559g","","","0.71073","MoKα","","0.032","0.0296","","","0.0756","0.0778","","","","","","1.06","","","","has coordinates","268511","2021-09-06","09:03:34",""
"7128515","7.266","0.003","11.193","0.004","14.501","0.005","70.164","0.013","79.38","0.016","81.797","0.018","1086.3","0.7","170","2","170","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 N2 O7 S -","- C22 H22 N2 O7 S -","- C44 H44 N4 O14 S2 -","2","1","","Zeng, Linwei; Jin, Jian; He, Jixiao; Cui, Sunliang","Photo-induced synthesis of β-sulfonyl imides from carboxylic acids.","Chemical communications (Cambridge, England)","2021","57","55","6792","6795","10.1039/d1cc02559g","","","0.71073","MoKα","","0.0391","0.0356","","","0.088","0.0909","","","","","","1.06","","","","has coordinates","268511","2021-09-06","09:03:35",""
"7128518","11.8829","0.0011","15.5031","0.0014","23.241","0.002","90","","90","","90","","4281.5","0.7","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C48 H56 Cl N2 P Si -","- C48 H56 Cl N2 P Si -","- C192 H224 Cl4 N8 P4 Si4 -","4","1","","Takahashi, Shintaro; Ishii, Akihiko; Nakata, Norio","Formation of silaimines from a sterically demanding iminophosphonamido chlorosilylene <i>via</i> intramolecular N-P bond cleavage.","Chemical communications (Cambridge, England)","2021","57","55","6728","6731","10.1039/d1cc02812j","","","0.71073","MoKα","","0.0599","0.0446","","","0.0868","0.0906","","","","","","1.01","","","","has coordinates","268509","2021-09-06","09:03:15",""
"7128519","10.6138","0.0009","18.8185","0.0016","19.6086","0.0017","90","","92.119","0.001","90","","3913.9","0.6","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C43 H49 Fe N2 O2 P Si -","- C43 H49 Fe N2 O2 P Si -","- C172 H196 Fe4 N8 O8 P4 Si4 -","4","1","","Takahashi, Shintaro; Ishii, Akihiko; Nakata, Norio","Formation of silaimines from a sterically demanding iminophosphonamido chlorosilylene <i>via</i> intramolecular N-P bond cleavage.","Chemical communications (Cambridge, England)","2021","57","55","6728","6731","10.1039/d1cc02812j","","","0.71073","MoKα","","0.0479","0.0354","","","0.0819","0.0854","","","","","","1.01","","","","has coordinates","268509","2021-09-06","09:03:17",""
"7128520","10.5282","0.0008","37.197","0.003","17.983","0.0017","90","","103.127","0.001","90","","6858.4","1","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H45 Cl2 N2 P Si -","- C36 H45 Cl2 N2 P Si -","- C288 H360 Cl16 N16 P8 Si8 -","8","2","","Takahashi, Shintaro; Ishii, Akihiko; Nakata, Norio","Formation of silaimines from a sterically demanding iminophosphonamido chlorosilylene <i>via</i> intramolecular N-P bond cleavage.","Chemical communications (Cambridge, England)","2021","57","55","6728","6731","10.1039/d1cc02812j","","","0.71073","MoKα","","0.0875","0.0663","","","0.1422","0.1668","","","","","","1.047","","","","has coordinates","268509","2021-09-06","09:03:17",""
"7128521","19.752","0.0008","18.912","0.0008","22.5192","0.0009","90","","92.001","0.001","90","","8406.9","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H62 N3 P Si3 -","- C42 H62 N3 P Si3 -","- C336 H496 N24 P8 Si24 -","8","2","","Takahashi, Shintaro; Ishii, Akihiko; Nakata, Norio","Formation of silaimines from a sterically demanding iminophosphonamido chlorosilylene <i>via</i> intramolecular N-P bond cleavage.","Chemical communications (Cambridge, England)","2021","57","55","6728","6731","10.1039/d1cc02812j","","","0.71073","MoKα","","0.1018","0.0695","","","0.1676","0.1993","","","","","","1.053","","","","has coordinates","268509","2021-09-06","09:03:17",""
"7128522","11.0279","0.0012","7.6848","0.0009","24.244","0.003","90","","90","","90","","2054.6","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H10 Cl F O2 -","- C10 H10 Cl F O2 -","- C80 H80 Cl8 F8 O16 -","8","1","","Hao, Fei; Shang, Xueyun; Liu, Zhenwei; Zhang, He; Lin, Jin-Hong; Xiao, Ji-Chang","Rh-catalyzed tunable defluorinative borylation.","Chemical communications (Cambridge, England)","2021","57","58","7124","7127","10.1039/d1cc02079j","","","0.71073","MoKα","","0.0905","0.0826","","","0.2336","0.2415","","","","","","1.116","","","","has coordinates,has disorder","268514","2021-09-06","09:04:21",""
"7128523","9.0099","0.0013","10.366","0.0015","11.4985","0.0016","67.411","0.002","86.553","0.002","87.881","0.002","989.6","0.2","296","2","296.15","","","","","","","","","3","P -1","-P 1","2","","","","- C27 H21 N -","- C27 H21 N -","- C54 H42 N2 -","2","1","","Chen, Xinyu; Yang, Na; Zeng, Wen; Wang, Lei; Li, Pinhua; Li, Hongji","Metal-free dearomative [5+2]/[2+2] cycloaddition of 1<i>H</i>-indoles with <i>ortho</i>-(trimethylsilyl)aryl triflates.","Chemical communications (Cambridge, England)","2021","57","57","7047","7050","10.1039/d1cc02550c","","","0.71073","MoKα","","0.1054","0.0582","","","0.141","0.1679","","","","","","1.007","","","","has coordinates","268546","2021-09-06","09:12:55",""
"7128524","18.566","0.002","5.4612","0.0007","14.391","0.002","90","","90","","90","","1459.1","0.3","296","2","296.15","","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C20 H15 N -","- C20 H15 N -","- C80 H60 N4 -","4","1","","Chen, Xinyu; Yang, Na; Zeng, Wen; Wang, Lei; Li, Pinhua; Li, Hongji","Metal-free dearomative [5+2]/[2+2] cycloaddition of 1<i>H</i>-indoles with <i>ortho</i>-(trimethylsilyl)aryl triflates.","Chemical communications (Cambridge, England)","2021","57","57","7047","7050","10.1039/d1cc02550c","","","0.71073","MoKα","","0.0866","0.0503","","","0.0844","0.0915","","","","","","1.025","","","","has coordinates","268546","2021-09-06","09:12:55",""
"7128525","27.124","0.003","7.6958","0.0015","16.5624","0.0016","90","","92.951","0.011","90","","3452.7","0.8","293","","293","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C19 H18 N2 O3 S -","- C19 H18 N2 O3 S -","- C152 H144 N16 O24 S8 -","8","1","","Hu, Weican; Zhang, Feiyang; Chen, Chen; Qi, Tianhang; Shen, Yanlong; Qian, Guoying; Rong, Zhouting","Metal-free C8-H functionalization of quinoline <i>N</i>-oxides with ynamides.","Chemical communications (Cambridge, England)","2021","57","57","6995","6998","10.1039/d1cc02138a","","x-ray","0.71073","MoKα","","0.1497","0.1076","","","0.2587","0.2998","","","","","","1.0482","","","","has coordinates","268542","2021-09-06","09:11:50",""
"7128526","11.673","0.003","15.834","0.004","22.536","0.005","90","","93.934","0.006","90","","4155.5","1.8","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H21 B F25 N6 V -","- C42 H21 B F25 N6 V -","- C168 H84 B4 F100 N24 V4 -","4","1","","Wong, Anthony; Chakraborty, Arunavo; Bawari, Deependra; Wu, Guang; Dobrovetsky, Roman; Ménard, Gabriel","Facile proton-coupled electron transfer enabled by coordination-induced E-H bond weakening to boron.","Chemical communications (Cambridge, England)","2021","57","56","6903","6906","10.1039/d1cc02832d","","","0.71073","MoKα","","0.0457","0.0329","","","0.0689","0.0754","","","","","","1.011","","","","has coordinates","268517","2021-09-06","09:05:37",""
"7128527","13.184","0.004","13.184","0.004","25.133","0.01","90","","90","","120","","3783","2","120","2","120","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C24 H13 F15 N5 V -","- C24 H13 F15 N5 V -","- C144 H78 F90 N30 V6 -","6","0.333333","","Wong, Anthony; Chakraborty, Arunavo; Bawari, Deependra; Wu, Guang; Dobrovetsky, Roman; Ménard, Gabriel","Facile proton-coupled electron transfer enabled by coordination-induced E-H bond weakening to boron.","Chemical communications (Cambridge, England)","2021","57","56","6903","6906","10.1039/d1cc02832d","","","0.71073","MoKα","","0.2272","0.0836","","","0.0632","0.0814","","","","","","1.093","","","","has coordinates","268517","2021-09-06","09:05:40",""
"7128528","36.734","0.014","36.734","0.014","27.197","0.01","90","","90","","120","","31783","2","100","2","100.03","","","","","","","","","7","R -3 :H","-R 3","148","","","","- C36 H14 B F25 K N6 V -","- C36 H14 B F25 K N6 V -","- C648 H252 B18 F450 K18 N108 V18 -","18","1","","Wong, Anthony; Chakraborty, Arunavo; Bawari, Deependra; Wu, Guang; Dobrovetsky, Roman; Ménard, Gabriel","Facile proton-coupled electron transfer enabled by coordination-induced E-H bond weakening to boron.","Chemical communications (Cambridge, England)","2021","57","56","6903","6906","10.1039/d1cc02832d","","","0.71073","MoKα","","0.2326","0.0846","","","0.2049","0.2798","","","","","","0.852","","","","has coordinates","268517","2021-09-06","09:05:49",""
"7128529","12.4395","0.0019","13.2732","0.0019","20.002","0.003","103.157","0.004","97.11","0.004","108.906","0.004","2971.6","0.8","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C62 H43 B Br Co F24 N6 V -","- C62 H43 B Br Co F24 N6 V -","- C124 H86 B2 Br2 Co2 F48 N12 V2 -","2","1","","Wong, Anthony; Chakraborty, Arunavo; Bawari, Deependra; Wu, Guang; Dobrovetsky, Roman; Ménard, Gabriel","Facile proton-coupled electron transfer enabled by coordination-induced E-H bond weakening to boron.","Chemical communications (Cambridge, England)","2021","57","56","6903","6906","10.1039/d1cc02832d","","","0.71073","MoKα","","0.0742","0.0574","","","0.1262","0.1365","","","","","","0.956","","","","has coordinates","268517","2021-09-06","09:05:52",""
"7128530","28.801","0.003","27.597","0.002","17.8997","0.0017","90","","121.133","0.002","90","","12177.9","1.9","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C62 H33 B Co F25 N6 V -","- C62 H33 B Co F25 N6 V -","- C496 H264 B8 Co8 F200 N48 V8 -","8","1","","Wong, Anthony; Chakraborty, Arunavo; Bawari, Deependra; Wu, Guang; Dobrovetsky, Roman; Ménard, Gabriel","Facile proton-coupled electron transfer enabled by coordination-induced E-H bond weakening to boron.","Chemical communications (Cambridge, England)","2021","57","56","6903","6906","10.1039/d1cc02832d","","","0.71073","MoKα","","0.0904","0.06","","","0.1584","0.1854","","","","","","0.996","","","","has coordinates,has disorder","268517","2021-09-06","09:05:52",""
"7128531","38.933","0.017","11.079","0.005","29.911","0.013","90","","105.567","0.006","90","","12429","9","110","2","110","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C64 H47 B Co F30 N5 O1.5 V -","- C64 H42 B Co F30 N5 O1.5 V -","- C512 H336 B8 Co8 F240 N40 O12 V8 -","8","1","","Wong, Anthony; Chakraborty, Arunavo; Bawari, Deependra; Wu, Guang; Dobrovetsky, Roman; Ménard, Gabriel","Facile proton-coupled electron transfer enabled by coordination-induced E-H bond weakening to boron.","Chemical communications (Cambridge, England)","2021","57","56","6903","6906","10.1039/d1cc02832d","","","0.71073","MoKα","","0.1413","0.0887","","","0.2251","0.27","","","","","","0.983","","","","has coordinates","268517","2021-09-06","09:05:52",""
"7128532","27.094","0.005","11.888","0.002","40.475","0.008","90","","94.917","0.004","90","","12989","4","100","2","100","2","","","","","","","","9","P 1 2/n 1","-P 2yac","13","","","","- C66 H57 B Co F25 N5 O S V -","- C66 H57 B Co F25 N5 O S V -","- C528 H456 B8 Co8 F200 N40 O8 S8 V8 -","8","2","","Wong, Anthony; Chakraborty, Arunavo; Bawari, Deependra; Wu, Guang; Dobrovetsky, Roman; Ménard, Gabriel","Facile proton-coupled electron transfer enabled by coordination-induced E-H bond weakening to boron.","Chemical communications (Cambridge, England)","2021","57","56","6903","6906","10.1039/d1cc02832d","","","0.71073","MoKα","","0.2397","0.1545","","","0.2872","0.3167","","","","","","1.214","","","","has coordinates","268517","2021-09-06","09:05:52",""
"7128533","8.4373","0.0015","8.8696","0.0018","15.702","0.003","90","","99.385","0.005","90","","1159.3","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H18 Br2 N2 -","- C30 H18 Br2 N2 -","- C60 H36 Br4 N4 -","2","0.5","","Liu, Kun; Huang, Kaiwei; Lv, Anqi; Ye, Wenpeng; Yang, Yijun; Shen, Kang; Zhi, Jiahuan; Wang, He; Zhang, Renxiang; Wang, Jiamin; Ma, Huili; Shi, Huifang; Yao, Wei; An, Zhongfu; Huang, Wei","Tunable microstructures of ultralong organic phosphorescence materials.","Chemical communications (Cambridge, England)","2021","57","59","7276","7279","10.1039/d1cc01563j","","","0.71073","MoKα","","0.0675","0.0398","","","0.0989","0.112","","","","","","1.027","","","","has coordinates","268589","2021-09-06","09:35:19",""
"7128534","8.462","0.003","8.889","0.003","15.712","0.005","90","","99.317","0.009","90","","1166.2","0.7","299","2","299","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H18 Br2 N2 -","- C30 H18 Br2 N2 -","- C60 H36 Br4 N4 -","2","0.5","","Liu, Kun; Huang, Kaiwei; Lv, Anqi; Ye, Wenpeng; Yang, Yijun; Shen, Kang; Zhi, Jiahuan; Wang, He; Zhang, Renxiang; Wang, Jiamin; Ma, Huili; Shi, Huifang; Yao, Wei; An, Zhongfu; Huang, Wei","Tunable microstructures of ultralong organic phosphorescence materials.","Chemical communications (Cambridge, England)","2021","57","59","7276","7279","10.1039/d1cc01563j","","","0.71073","MoKα","","0.0829","0.0444","","","0.116","0.1344","","","","","","1.025","","","","has coordinates","268589","2021-09-06","09:35:19",""
"7128535","8.71","0.003","17.149","0.005","8.657","0.003","90","","116.339","0.005","90","","1158.8","0.7","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H18 Br2 N2 -","- C30 H18 Br2 N2 -","- C60 H36 Br4 N4 -","2","0.5","","Liu, Kun; Huang, Kaiwei; Lv, Anqi; Ye, Wenpeng; Yang, Yijun; Shen, Kang; Zhi, Jiahuan; Wang, He; Zhang, Renxiang; Wang, Jiamin; Ma, Huili; Shi, Huifang; Yao, Wei; An, Zhongfu; Huang, Wei","Tunable microstructures of ultralong organic phosphorescence materials.","Chemical communications (Cambridge, England)","2021","57","59","7276","7279","10.1039/d1cc01563j","","","0.71073","MoKα","","0.0631","0.0409","","","0.0879","0.0966","","","","","","1.075","","","","has coordinates","268589","2021-09-06","09:35:19",""
"7128536","21.689","0.002","23.58","0.002","24.848","0.003","97.165","0.002","110.855","0.002","115.142","0.002","10162.1","1.8","190","1","190","1","","","","","","","","5","P -1","-P 1","2","","cluster-1","","- C250 H264 Eu18 N16 O107 -","- C250 H264 Eu18 N16 O107 -","- C250 H264 Eu18 N16 O107 -","1","0.5","","Ma, Yanan; Yang, Xiaoping; Xiao, Zhiyin; Liu, Xiaoming; Shi, Dongliang; Niu, Mengyu; Schipper, Desmond","One high-nuclearity Eu<sub>18</sub> nanoring with rapid ratiometric fluorescence response to dipicolinic acid (an anthrax biomarker).","Chemical communications (Cambridge, England)","2021","57","59","7316","7319","10.1039/d1cc01706c","","","0.71073","MoKα","","0.1441","0.0804","","","0.1712","0.2159","","","","","","1.163","","","","has coordinates","268586","2021-09-06","09:34:24",""
"7128537","6.1683","0.0009","18.221","0.003","8.3375","0.0014","90","","100.838","0.005","90","","920.4","0.3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H21 N O2 S -","- C21 H21 N O2 S -","- C42 H42 N2 O4 S2 -","2","1","","Gogoi, Manash Protim; Vanjari, Rajeshwer; Prabagar, B.; Yang, Shengwen; Dutta, Shubham; Mallick, Rajendra K.; Gandon, Vincent; Sahoo, Akhila K.","Yb(iii)-catalysed syn-thioallylation of ynamides.","Chemical communications (Cambridge, England)","2021","57","61","7521","7524","10.1039/d1cc02611a","","","0.71073","MoKα","","0.0316","0.0287","","","0.073","0.0744","","","","","","1.056","","","","has coordinates","268494","2021-09-06","08:51:27",""
"7128538","16.6558","0.0003","11.3245","0.0003","23.4109","0.0004","90","","90","","90","","4415.73","0.16","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C28 H64 Br2 Cr2 N2 O18 -","- C28 H64 Br2 Cr2 N2 O18 -","- C112 H256 Br8 Cr8 N8 O72 -","4","1","","Zhou, Xun-Hui; Zeng, Ying; Tang, Shao-Bin; Yu, Zi-Ru; Cao, Li-Ming; Du, Zi-Yi; He, Chun-Ting","Solid solutions of flexible host-guest supramolecules for tuning molecular motion and phase transitions.","Chemical communications (Cambridge, England)","2021","57","59","7292","7295","10.1039/d1cc02061g","","","1.54178","CuKα","","0.0926","0.0799","","","0.2401","0.2632","","","","","","1.041","","","","has coordinates,has disorder","268581","2021-09-06","09:32:58",""
"7128539","8.417","0.004","11.396","0.005","23.622","0.01","90","","90","","90","","2265.8","1.8","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C14 H32 Br Cr N O9 -","- C14 H32 Br Cr N O9 -","- C56 H128 Br4 Cr4 N4 O36 -","4","0.5","","Zhou, Xun-Hui; Zeng, Ying; Tang, Shao-Bin; Yu, Zi-Ru; Cao, Li-Ming; Du, Zi-Yi; He, Chun-Ting","Solid solutions of flexible host-guest supramolecules for tuning molecular motion and phase transitions.","Chemical communications (Cambridge, England)","2021","57","59","7292","7295","10.1039/d1cc02061g","","","0.71073","MoKα","","0.0872","0.0569","","","0.1587","0.1825","","","","","","1.031","","","","has coordinates,has disorder","268581","2021-09-06","09:33:03",""
"7128540","8.6959","0.0003","11.6717","0.0005","12.2829","0.0005","109.137","0.004","98.956","0.003","98.155","0.003","1138.29","0.09","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H31 Br2 Cr N O9 -","- C14 H31 Br2 Cr N O9 -","- C28 H62 Br4 Cr2 N2 O18 -","2","1","","Zhou, Xun-Hui; Zeng, Ying; Tang, Shao-Bin; Yu, Zi-Ru; Cao, Li-Ming; Du, Zi-Yi; He, Chun-Ting","Solid solutions of flexible host-guest supramolecules for tuning molecular motion and phase transitions.","Chemical communications (Cambridge, England)","2021","57","59","7292","7295","10.1039/d1cc02061g","","","0.71073","MoKα","","0.0825","0.0567","","","0.1331","0.1464","","","","","","1.066","","","","has coordinates,has disorder","268581","2021-09-06","09:33:08",""
"7128541","8.7327","0.0003","11.6396","0.0004","12.0019","0.0004","107.718","0.002","100.411","0.002","98.142","0.002","1117.48","0.07","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H31 Br2 Cr N O9 -","- C14 H31 Br2 Cr N O9 -","- C28 H62 Br4 Cr2 N2 O18 -","2","1","","Zhou, Xun-Hui; Zeng, Ying; Tang, Shao-Bin; Yu, Zi-Ru; Cao, Li-Ming; Du, Zi-Yi; He, Chun-Ting","Solid solutions of flexible host-guest supramolecules for tuning molecular motion and phase transitions.","Chemical communications (Cambridge, England)","2021","57","59","7292","7295","10.1039/d1cc02061g","","","0.71073","MoKα","","0.0261","0.021","","","0.0522","0.0538","","","","","","1.029","","","","has coordinates","268581","2021-09-06","09:33:10",""
"7128542","9.3047","0.0002","9.9702","0.0002","17.0352","0.0004","73.988","0.001","80.773","0.001","80.419","0.001","1486.89","0.06","193","2","193.01","","","","","","","","","6","P -1","-P 1","2","","","","- C33 H24 Br2 F3 N O5 -","- C33 H24 Br2 F3 N O5 -","- C66 H48 Br4 F6 N2 O10 -","2","1","","Rong, Binsen; Xu, Gaochen; Yan, Huan; Zhang, Sai; Wu, Qinghuan; Zhu, Ning; Duan, Jindian; Guo, Kai","The copper-catalyzed synthesis of dihydrooxazoles from α,β-unsaturated ketoximes and activated ketones.","Chemical communications (Cambridge, England)","2021","57","59","7272","7275","10.1039/d1cc02422a","","","1.34139","GaKα","","0.0723","0.0465","","","0.0957","0.1098","","","","","","1.032","","","","has coordinates","268582","2021-09-06","09:33:24",""
"7128543","6.85821","0.00012","12.4948","0.0003","15.2391","0.0003","72.5999","0.0017","78.0024","0.0016","89.0863","0.0016","1217.4","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H25 Cl2 N O7 -","- C24 H25 Cl2 N O7 -","- C48 H50 Cl4 N2 O14 -","2","1","","Giel, Marie-Claire; Barrow, Andrew S.; Smedley, Christopher J.; Lewis, William; Moses, John E.","Aminium cation-radical catalysed selective hydration of (<i>E</i>)-aryl enynes.","Chemical communications (Cambridge, England)","2021","57","57","6991","6994","10.1039/d1cc02257a","","x-ray","1.54184","CuKα","","0.056","0.0532","","","0.132","0.1339","","","","","","1.053","","","","has coordinates,has disorder","268539","2021-09-06","09:11:03",""
"7128544","11.2665","0.0004","7.248","0.0003","15.249","0.0006","90","","90","","90","","1245.23","0.08","100","","100","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C4 H12 Au2 Cu N8 -","- C4 H12 Au2 Cu N8 -","- C16 H48 Au8 Cu4 N32 -","4","0.5","","Priola, Emanuele; Mahmoudi, Ghodrat; Andreo, Jacopo; Frontera, Antonio","Unprecedented [d<sup>9</sup>]Cu[d<sup>10</sup>]Au coinage bonding interactions in {Cu(NH<sub>3</sub>)<sub>4</sub>[Au(CN)<sub>2</sub>]}<sup>+</sup>[Au(CN)<sub>2</sub>]<sup>-</sup> salt.","Chemical communications (Cambridge, England)","2021","57","59","7268","7271","10.1039/d1cc02709c","","x-ray","0.71073","MoKα","","0.0348","0.0299","","","0.0787","0.0815","","","","","","1.0224","","","","has coordinates","268583","2021-09-06","09:33:43",""
"7128547","9.73","0.0002","11.7702","0.0003","16.4807","0.0004","90","","90","","90","","1887.44","0.08","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H26 N2 O4 S -","- C17 H26 N2 O4 S -","- C68 H104 N8 O16 S4 -","4","1","","Xiong, Qian; Luo, Qiliang; Zhang, Tinghui; Dong, Shunxi; Liu, Xiaohua; Feng, Xiaoming","Catalytic asymmetric multicomponent reactions of isocyanide, isothiocyanate and alkylidene malonates.","Chemical communications (Cambridge, England)","2021","57","59","7288","7291","10.1039/d1cc02939h","","","1.54178","CuKα","","0.0256","0.0252","","","0.0699","0.0704","","","","","","1.101","","","","has coordinates","268585","2021-09-06","09:34:11",""
"7128548","12.4981","0.0005","17.3226","0.0008","8.4593","0.0004","90","","90","","90","","1831.43","0.14","173","2","173","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C18 H22 N2 O4 S -","- C18 H22 N2 O4 S -","- C72 H88 N8 O16 S4 -","4","1","","Xiong, Qian; Luo, Qiliang; Zhang, Tinghui; Dong, Shunxi; Liu, Xiaohua; Feng, Xiaoming","Catalytic asymmetric multicomponent reactions of isocyanide, isothiocyanate and alkylidene malonates.","Chemical communications (Cambridge, England)","2021","57","59","7288","7291","10.1039/d1cc02939h","","","0.71073","MoKα","","0.0366","0.0308","","","0.0664","0.0678","","","","","","1.066","","","","has coordinates","268585","2021-09-06","09:34:14",""
"7128549","12.9385","0.0003","12.1873","0.0003","12.986","0.0003","90","","101.514","0.0015","90","","2006.5","0.08","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 Cl2 F6 N4 Ni P -","- C16 H20 Cl2 F6 N4 Ni P -","- C64 H80 Cl8 F24 N16 Ni4 P4 -","4","1","","Na, Hanah; Watson, Michael B.; Tang, Fengzhi; Rath, Nigam P.; Mirica, Liviu M.","Photoreductive chlorine elimination from a Ni(iii)Cl<sub>2</sub> complex supported by a tetradentate pyridinophane ligand.","Chemical communications (Cambridge, England)","2021","57","59","7264","7267","10.1039/d1cc02114a","","","0.71073","MoKα","","0.0711","0.0451","","","0.1002","0.1129","","","","","","1.021","","","","has coordinates,has disorder","268590","2021-09-06","09:35:28",""
"7128550","19.4628","0.0006","13.3212","0.0004","9.6192","0.0003","90","","90","","90","","2493.95","0.13","100","","100","","","","","","","","","8","P n a 21","P 2c -2n","33","","","","- C18 H25 Cl4 F6 N4 Ni O P -","- C18 H25 Cl4 F6 N4 Ni O P -","- C72 H100 Cl16 F24 N16 Ni4 O4 P4 -","4","1","","Na, Hanah; Watson, Michael B.; Tang, Fengzhi; Rath, Nigam P.; Mirica, Liviu M.","Photoreductive chlorine elimination from a Ni(iii)Cl<sub>2</sub> complex supported by a tetradentate pyridinophane ligand.","Chemical communications (Cambridge, England)","2021","57","59","7264","7267","10.1039/d1cc02114a","","","0.71073","MoKα","","0.0323","0.0316","","","0.1025","0.104","","","","","","0.969","","","","has coordinates,has disorder","268590","2021-09-06","09:35:31",""
"7128551","20.746","0.003","20.746","0.003","20.746","0.003","90","","90","","90","","8929","2","100","","100","","","","","","","","","5","I -4 3 m","I -4 2 3","217","","","","- C123 H151 Cu12 N17 O69 -","- C108 H115.999 Cu12 N12 O63.9996 -","- C216 H231.998 Cu24 N24 O127.999 -","2","0.0416667","","Jackson, Nathan; Vazquez, Irma Rocio; Chen, Ying-Pin; Chen, Yu-Sheng; Gao, Wen-Yang","A porous supramolecular ionic solid.","Chemical communications (Cambridge, England)","2021","57","59","7248","7251","10.1039/d1cc02806e","","","0.41328","synchrotron","","0.0298","0.0291","","","0.0801","0.0813","","","","","","1.065","","","","has coordinates,has disorder","268584","2021-09-06","09:33:56",""
"7128552","14.5609","0.0006","9.3002","0.0004","14.7714","0.0007","90","","94.995","0.004","90","","1992.74","0.15","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C25 H18 O4 -","- C25 H18 O4 -","- C100 H72 O16 -","4","1","","Xi, Jinhu; Wu, Xinjie; Huang, Mengmeng; Kim, Jung Keun; Zhang, Jianye; Li, Yabo; Wu, Yangjie","A visible-light-induced photocatalyst-free approach for C-3 dicarbonyl coumarin production.","Chemical communications (Cambridge, England)","2021","57","59","7308","7311","10.1039/d1cc02399c","","x-ray","1.54184","CuKα","","0.0667","0.0477","","","0.1199","0.1383","","","","","","1.028","","","","has coordinates","268588","2021-09-06","09:35:03",""
"7128553","7.1288","0.0011","7.3017","0.0009","13.738","0.002","94.814","0.011","90.307","0.013","112.254","0.014","658.96","0.18","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C17 H10 O4 -","- C17 H10 O4 -","- C34 H20 O8 -","2","1","","Xi, Jinhu; Wu, Xinjie; Huang, Mengmeng; Kim, Jung Keun; Zhang, Jianye; Li, Yabo; Wu, Yangjie","A visible-light-induced photocatalyst-free approach for C-3 dicarbonyl coumarin production.","Chemical communications (Cambridge, England)","2021","57","59","7308","7311","10.1039/d1cc02399c","","x-ray","1.54184","CuKα","","0.0994","0.0638","","","0.1804","0.2205","","","","","","1.035","","","","has coordinates","268588","2021-09-06","09:35:08",""
"7128554","19.224","0.002","20.02","0.002","10.0058","0.0012","90","","97.418","0.01","90","","3818.6","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 O4 -","- C24 H16 O4 -","- C192 H128 O32 -","8","2","","Xi, Jinhu; Wu, Xinjie; Huang, Mengmeng; Kim, Jung Keun; Zhang, Jianye; Li, Yabo; Wu, Yangjie","A visible-light-induced photocatalyst-free approach for C-3 dicarbonyl coumarin production.","Chemical communications (Cambridge, England)","2021","57","59","7308","7311","10.1039/d1cc02399c","","x-ray","1.54184","CuKα","","0.0895","0.0565","","","0.1447","0.1779","","","","","","1.026","","","","has coordinates","268588","2021-09-06","09:35:10",""
"7128555","8.6807","0.0007","9.5045","0.0007","13.7955","0.001","98.101","0.003","97.742","0.002","103.706","0.003","1077.91","0.14","150","","150","","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C32 H19 O P -","- C32 H19 O P -","- C64 H38 O2 P2 -","2","1","","Mokrai, Réka; Mocanu, Anabella; Duffy, Matthew P.; Vives, Thomas; Caytan, Elsa; Dorcet, Vincent; Roisnel, Thierry; Nyulászi, László; Benkő, Zoltán; Bouit, Pierre-Antoine; Hissler, Muriel","Stereospecific synthesis of chiral P-containing polyaromatics based on 7-membered P-rings.","Chemical communications (Cambridge, England)","2021","57","59","7256","7259","10.1039/d1cc02293h","","x-ray","0.71073","MoKα","","0.0414","0.0365","","","0.0938","0.0971","","","","","","1.025","","","","has coordinates","268580","2021-09-06","09:32:27",""
"7128556","9.0391","0.0011","20.028","0.003","14.2025","0.0019","90","","108.406","0.004","90","","2439.6","0.6","150","","150","","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H21 Au Cl P -","- C32 H21 Au Cl P -","- C128 H84 Au4 Cl4 P4 -","4","1","","Mokrai, Réka; Mocanu, Anabella; Duffy, Matthew P.; Vives, Thomas; Caytan, Elsa; Dorcet, Vincent; Roisnel, Thierry; Nyulászi, László; Benkő, Zoltán; Bouit, Pierre-Antoine; Hissler, Muriel","Stereospecific synthesis of chiral P-containing polyaromatics based on 7-membered P-rings.","Chemical communications (Cambridge, England)","2021","57","59","7256","7259","10.1039/d1cc02293h","","x-ray","0.71073","MoKα","","0.0297","0.0266","","","0.0635","0.0651","","","","","","1.093","","","","has coordinates","268580","2021-09-06","09:32:30",""
"7128557","11.5367","0.0012","14.1314","0.0016","15.3922","0.0019","90","","90","","90","","2509.4","0.5","150","2","150","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H21 Cl2 O P -","- C33 H21 Cl2 O P -","- C132 H84 Cl8 O4 P4 -","4","1","","Mokrai, Réka; Mocanu, Anabella; Duffy, Matthew P.; Vives, Thomas; Caytan, Elsa; Dorcet, Vincent; Roisnel, Thierry; Nyulászi, László; Benkő, Zoltán; Bouit, Pierre-Antoine; Hissler, Muriel","Stereospecific synthesis of chiral P-containing polyaromatics based on 7-membered P-rings.","Chemical communications (Cambridge, England)","2021","57","59","7256","7259","10.1039/d1cc02293h","","x-ray","0.71073","MoKα","","0.057","0.0499","","","0.1316","0.1393","","","","","","1.062","","","","has coordinates","268580","2021-09-06","09:32:35",""
"7128558","8.3929","0.0007","15.4894","0.0012","17.31","0.0016","90","","90","","90","","2250.3","0.3","150","2","150","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H21 O P -","- C32 H21 O P -","- C128 H84 O4 P4 -","4","1","","Mokrai, Réka; Mocanu, Anabella; Duffy, Matthew P.; Vives, Thomas; Caytan, Elsa; Dorcet, Vincent; Roisnel, Thierry; Nyulászi, László; Benkő, Zoltán; Bouit, Pierre-Antoine; Hissler, Muriel","Stereospecific synthesis of chiral P-containing polyaromatics based on 7-membered P-rings.","Chemical communications (Cambridge, England)","2021","57","59","7256","7259","10.1039/d1cc02293h","","x-ray","0.71073","MoKα","","0.0428","0.0366","","","0.0847","0.0881","","","","","","1.04","","","","has coordinates","268580","2021-09-06","09:32:37",""
"7128559","11.636","0.003","14.154","0.003","15.569","0.003","90","","90","","90","","2564.2","1","293","2","293","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H21 Cl2 O P -","- C33 H21 Cl2 O P -","- C132 H84 Cl8 O4 P4 -","4","1","","Mokrai, Réka; Mocanu, Anabella; Duffy, Matthew P.; Vives, Thomas; Caytan, Elsa; Dorcet, Vincent; Roisnel, Thierry; Nyulászi, László; Benkő, Zoltán; Bouit, Pierre-Antoine; Hissler, Muriel","Stereospecific synthesis of chiral P-containing polyaromatics based on 7-membered P-rings.","Chemical communications (Cambridge, England)","2021","57","59","7256","7259","10.1039/d1cc02293h","","x-ray","0.71073","MoKα","","0.1225","0.0794","","","0.2281","0.2668","","","","","","1.043","","","","has coordinates","268580","2021-09-06","09:32:37",""
"7128560","8.4045","0.0005","15.4654","0.0008","17.2962","0.0011","90","","90","","90","","2248.1","0.2","150","2","150","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H21 O P -","- C32 H21 O P -","- C128 H84 O4 P4 -","4","1","","Mokrai, Réka; Mocanu, Anabella; Duffy, Matthew P.; Vives, Thomas; Caytan, Elsa; Dorcet, Vincent; Roisnel, Thierry; Nyulászi, László; Benkő, Zoltán; Bouit, Pierre-Antoine; Hissler, Muriel","Stereospecific synthesis of chiral P-containing polyaromatics based on 7-membered P-rings.","Chemical communications (Cambridge, England)","2021","57","59","7256","7259","10.1039/d1cc02293h","","x-ray","0.71073","MoKα","","0.0513","0.041","","","0.1021","0.1083","","","","","","1.035","","","","has coordinates","268580","2021-09-06","09:32:37",""
"7128561","14.699","0.003","15.681","0.003","24.869","0.004","90","","90","","90","","5732.2","1.8","150","","150","","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H21 Au Cl P -","- C32 H21 Au Cl P -","- C256 H168 Au8 Cl8 P8 -","8","2","","Mokrai, Réka; Mocanu, Anabella; Duffy, Matthew P.; Vives, Thomas; Caytan, Elsa; Dorcet, Vincent; Roisnel, Thierry; Nyulászi, László; Benkő, Zoltán; Bouit, Pierre-Antoine; Hissler, Muriel","Stereospecific synthesis of chiral P-containing polyaromatics based on 7-membered P-rings.","Chemical communications (Cambridge, England)","2021","57","59","7256","7259","10.1039/d1cc02293h","","x-ray","0.71073","MoKα","","0.0454","0.0438","","","0.1123","0.1135","","","","","","1.065","","","","has coordinates","268580","2021-09-06","09:32:37",""
"7128562","17.235","0.003","5.705","0.0011","18.5","0.004","90","","111.66","0.014","90","","1690.6","0.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H14 Br2 N2 -","- C19 H14 Br2 N2 -","- C76 H56 Br8 N8 -","4","1","","Fang, Lili; Fan, Shuaixin; Wu, Weiping; Li, Tielei; Zhu, Jin","Ruthenium-catalyzed room-temperature coupling of α-keto sulfoxonium ylides and cyclopropanols for δ-diketone synthesis.","Chemical communications (Cambridge, England)","2021","57","60","7386","7389","10.1039/d1cc02576g","","","1.54178","CuKα","","0.0256","0.0241","","","0.06","0.0612","","","","","","1.059","","","","has coordinates","268578","2021-09-06","09:32:05",""
"7128563","8.7421","0.0002","22.1857","0.0006","11.8409","0.0003","90","","93.675","0.001","90","","2291.82","0.1","100","","100","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H13 F6 I N4 O7 S2 -","- C15 H13 F6 I N4 O7 S2 -","- C60 H52 F24 I4 N16 O28 S8 -","4","1","","Boelke, Andreas; Sadat, Soleicha; Lork, Enno; Nachtsheim, Boris J.","Pseudocyclic bis-N-heterocycle-stabilized iodanes - synthesis, characterization and applications.","Chemical communications (Cambridge, England)","2021","57","60","7434","7437","10.1039/d1cc03097c","","x-ray","0.71073","MoKα","","0.0233","0.0185","","","0.0422","0.0439","","","","","","1.054","","","","has coordinates","268576","2021-09-06","09:31:44",""
"7128564","16.7429","0.0001","10.5512","0.0001","14.6971","0.0001","90","","93.247","0.001","90","","2592.19","0.03","99.97","0.11","99.97","0.11","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H14 O3 -","- C16 H14 O3 -","- C128 H112 O24 -","8","1","","Zhang, Jingran; Jalil, Ayesha; He, Jiaxin; Yu, Zhenyang; Cheng, Yifu; Li, Guangchen; Du, Yunfei; Zhao, Kang","Lactonization with concomitant 1,2-aryl migration and alkoxylation mediated by dialkoxyphenyl iodides generated <i>in situ</i>.","Chemical communications (Cambridge, England)","2021","57","60","7426","7429","10.1039/d1cc03110d","","x-ray","1.54184","CuKα","","0.035","0.0341","","","0.0848","0.0855","","","","","","1.088","","","","has coordinates","268579","2021-09-06","09:32:11",""
"7128565","8.7527","0.0002","21.114","0.0004","21.2756","0.0004","105.531","0.001","100.815","0.001","97.69","0.001","3649.92","0.13","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C37.5 H33 B Cl F9 N2 O5 -","- C37.5 H33 B Cl F9 N2 O5 -","- C150 H132 B4 Cl4 F36 N8 O20 -","4","2","","Li, Jun; Daniliuc, Constantin G.; Matern, Jonas; Fernández, Gustavo; Kehr, Gerald; Erker, Gerhard","Multi-component synthesis of dihydro-1,3-azaborinine derived oxindole isosteres.","Chemical communications (Cambridge, England)","2021","57","62","7689","7692","10.1039/d1cc02557k","","","1.54178","CuKα","","0.0462","0.0345","","","0.0786","0.084","","","","","","1.031","","","","has coordinates","268555","2021-09-06","09:16:37",""
"7128566","13.6617","0.0003","14.004","0.0003","18.5575","0.0004","70.233","0.001","87.771","0.001","83.541","0.001","3319.98","0.13","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H28 B F9 N2 O3 -","- C35 H28 B F9 N2 O3 -","- C140 H112 B4 F36 N8 O12 -","4","2","","Li, Jun; Daniliuc, Constantin G.; Matern, Jonas; Fernández, Gustavo; Kehr, Gerald; Erker, Gerhard","Multi-component synthesis of dihydro-1,3-azaborinine derived oxindole isosteres.","Chemical communications (Cambridge, England)","2021","57","62","7689","7692","10.1039/d1cc02557k","","","1.54178","CuKα","","0.078","0.0527","","","0.1321","0.1482","","","","","","1.02","","","","has coordinates,has disorder","268555","2021-09-06","09:16:38",""
"7128567","15.163","0.0003","26.207","0.0005","15.9881","0.0003","90","","101.068","0.001","90","","6235.1","0.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H24 B F9 N2 O3 S2 -","- C31 H24 B F9 N2 O3 S2 -","- C248 H192 B8 F72 N16 O24 S16 -","8","2","","Li, Jun; Daniliuc, Constantin G.; Matern, Jonas; Fernández, Gustavo; Kehr, Gerald; Erker, Gerhard","Multi-component synthesis of dihydro-1,3-azaborinine derived oxindole isosteres.","Chemical communications (Cambridge, England)","2021","57","62","7689","7692","10.1039/d1cc02557k","","","1.54178","CuKα","","0.0587","0.0413","","","0.1004","0.1103","","","","","","1.012","","","","has coordinates,has disorder","268555","2021-09-06","09:16:38",""
"7128568","9.3498","0.0004","7.3678","0.0003","27.1186","0.001","90","","98.469","0.004","90","","1847.76","0.13","100.01","0.1","100.01","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H29 N Si -","- C21 H29 N Si -","- C84 H116 N4 Si4 -","4","1","","Pocock, Ian A.; Alotaibi, Alya M.; Jagdev, Kesar; Prior, Connor; Burgess, Gregory R.; Male, Louise; Grainger, Richard S.","Direct formation of 4,5-disubstituted carbazoles via regioselective dilithiation.","Chemical communications (Cambridge, England)","2021","57","59","7252","7255","10.1039/d1cc02892h","","x-ray","1.54184","CuKα","","0.0679","0.0581","","","0.1456","0.1522","","","","","","1.052","","","","has coordinates,has disorder","268587","2021-09-06","09:34:44",""
"7128569","9.9907","0.0004","6.748","0.0003","14.9843","0.0006","90","","95.086","0.004","90","","1006.22","0.07","100","0.1","100","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H7 N Se2 -","- C12 H7 N Se2 -","- C48 H28 N4 Se8 -","4","1","","Pocock, Ian A.; Alotaibi, Alya M.; Jagdev, Kesar; Prior, Connor; Burgess, Gregory R.; Male, Louise; Grainger, Richard S.","Direct formation of 4,5-disubstituted carbazoles via regioselective dilithiation.","Chemical communications (Cambridge, England)","2021","57","59","7252","7255","10.1039/d1cc02892h","","x-ray","1.54184","CuKα","","0.0236","0.0215","","","0.055","0.0561","","","","","","1.12","","","","has coordinates","268587","2021-09-06","09:34:44",""
"7128570","8.2725","0.0004","19.9141","0.0009","13.8083","0.0007","90","","101.265","0.005","90","","2230.95","0.19","100.01","0.1","100.01","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H27 F4 N Si -","- C27 H27 F4 N Si -","- C108 H108 F16 N4 Si4 -","4","1","","Pocock, Ian A.; Alotaibi, Alya M.; Jagdev, Kesar; Prior, Connor; Burgess, Gregory R.; Male, Louise; Grainger, Richard S.","Direct formation of 4,5-disubstituted carbazoles via regioselective dilithiation.","Chemical communications (Cambridge, England)","2021","57","59","7252","7255","10.1039/d1cc02892h","","x-ray","1.54184","CuKα","","0.0451","0.0377","","","0.0961","0.1036","","","","","","1.04","","","","has coordinates","268587","2021-09-06","09:34:44",""
"7128571","19.2612","0.0006","19.2612","0.0006","9.9892","0.0005","90","","90","","120","","3209.4","0.2","100","0.1","100","0.1","","","","","","","","5","P 61","P 61","169","","","","- C23 H33 N O2 Si -","- C23 H33 N O2 Si -","- C138 H198 N6 O12 Si6 -","6","1","","Pocock, Ian A.; Alotaibi, Alya M.; Jagdev, Kesar; Prior, Connor; Burgess, Gregory R.; Male, Louise; Grainger, Richard S.","Direct formation of 4,5-disubstituted carbazoles via regioselective dilithiation.","Chemical communications (Cambridge, England)","2021","57","59","7252","7255","10.1039/d1cc02892h","","x-ray","1.54184","CuKα","","0.0684","0.0611","","","0.1663","0.1764","","","","","","1.055","","","","has coordinates,has disorder","268587","2021-09-06","09:34:44",""
"7128572","13.126","0.0005","15.4832","0.0004","12.3174","0.0005","90","","117.891","0.005","90","","2212.51","0.17","100.01","0.1","100.01","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H33 N Si2 -","- C23 H33 N Si2 -","- C92 H132 N4 Si8 -","4","1","","Pocock, Ian A.; Alotaibi, Alya M.; Jagdev, Kesar; Prior, Connor; Burgess, Gregory R.; Male, Louise; Grainger, Richard S.","Direct formation of 4,5-disubstituted carbazoles via regioselective dilithiation.","Chemical communications (Cambridge, England)","2021","57","59","7252","7255","10.1039/d1cc02892h","","x-ray","1.54184","CuKα","","0.0417","0.0361","","","0.0962","0.1018","","","","","","1.043","","","","has coordinates","268587","2021-09-06","09:34:44",""
"7128573","3.8267","0.0002","14.2898","0.0006","17.5522","0.0007","90","","90","","90","","959.8","0.07","100","0.1","100","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H7 Cl2 N -","- C12 H7 Cl2 N -","- C48 H28 Cl8 N4 -","4","1","","Pocock, Ian A.; Alotaibi, Alya M.; Jagdev, Kesar; Prior, Connor; Burgess, Gregory R.; Male, Louise; Grainger, Richard S.","Direct formation of 4,5-disubstituted carbazoles via regioselective dilithiation.","Chemical communications (Cambridge, England)","2021","57","59","7252","7255","10.1039/d1cc02892h","","x-ray","1.54184","CuKα","","0.0298","0.027","","","0.0664","0.0683","","","","","","1.073","","","","has coordinates","268587","2021-09-06","09:34:44",""
"7128574","9.0996","0.0003","14.8381","0.0005","29.5722","0.0008","90","","90","","90","","3992.9","0.2","100.01","0.1","100.01","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C23 H31 N O Si -","- C23 H31 N O Si -","- C184 H248 N8 O8 Si8 -","8","1","","Pocock, Ian A.; Alotaibi, Alya M.; Jagdev, Kesar; Prior, Connor; Burgess, Gregory R.; Male, Louise; Grainger, Richard S.","Direct formation of 4,5-disubstituted carbazoles via regioselective dilithiation.","Chemical communications (Cambridge, England)","2021","57","59","7252","7255","10.1039/d1cc02892h","","x-ray","1.54184","CuKα","","0.047","0.0409","","","0.1093","0.1159","","","","","","1.036","","","","has coordinates","268587","2021-09-06","09:34:44",""
"7128575","9.3372","0.0006","10.5025","0.0006","10.6156","0.0006","92.683","0.004","108.926","0.005","91.966","0.005","982.3","0.11","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C12 H7 N S2 -","- C12 H7 N S2 -","- C48 H28 N4 S8 -","4","2","","Pocock, Ian A.; Alotaibi, Alya M.; Jagdev, Kesar; Prior, Connor; Burgess, Gregory R.; Male, Louise; Grainger, Richard S.","Direct formation of 4,5-disubstituted carbazoles via regioselective dilithiation.","Chemical communications (Cambridge, England)","2021","57","59","7252","7255","10.1039/d1cc02892h","","x-ray","1.54184","CuKα","","0.0335","0.0292","","","0.0741","0.0776","","","","","","1.047","","","","has coordinates","268587","2021-09-06","09:34:44",""
"7128576","9.941","0.005","34.115","0.013","10.622","0.004","90","","106.275","0.014","90","","3458","3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","DIC","DIC","","- C36 H63 Al N2 -","- C36 H63 Al N2 -","- C144 H252 Al4 N8 -","4","1","","Drescher, Regina; Ritschel, Benedikt; Dewhurst, Rian D.; Deißenberger, Andrea; Hofmann, Alexander; Braunschweig, Holger","Synthesis of novel six-, seven- and eight-membered aluminum-containing rings by alumole ring expansion.","Chemical communications (Cambridge, England)","2021","57","61","7505","7508","10.1039/d1cc02993b","","","0.71073","MoKα","","0.0728","0.0599","","","0.1404","0.1457","","","","","","1.166","","","","has coordinates","268497","2021-09-06","08:53:44",""
"7128577","9.255","0.003","13.353","0.003","17.129","0.005","83.886","0.006","83.022","0.011","71.208","0.007","1984","1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Iminoborane","Iminoborane","","- C42 H69 Al B N -","- C42 H69 Al B N -","- C84 H138 Al2 B2 N2 -","2","1","","Drescher, Regina; Ritschel, Benedikt; Dewhurst, Rian D.; Deißenberger, Andrea; Hofmann, Alexander; Braunschweig, Holger","Synthesis of novel six-, seven- and eight-membered aluminum-containing rings by alumole ring expansion.","Chemical communications (Cambridge, England)","2021","57","61","7505","7508","10.1039/d1cc02993b","","","0.71073","MoKα","","0.0579","0.0455","","","0.1097","0.1185","","","","","","1.021","","","","has coordinates","268497","2021-09-06","08:53:48",""
"7128578","10.3237","0.0016","10.969","0.002","13.631","0.002","69.689","0.008","83.282","0.007","74.821","0.006","1396.5","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Dimer Sauerstoff insertion","Dimer Sauerstoff insertion","","- C58 H98 Al2 O4 -","- C58 H98 Al2 O4 -","- C58 H98 Al2 O4 -","1","0.5","","Drescher, Regina; Ritschel, Benedikt; Dewhurst, Rian D.; Deißenberger, Andrea; Hofmann, Alexander; Braunschweig, Holger","Synthesis of novel six-, seven- and eight-membered aluminum-containing rings by alumole ring expansion.","Chemical communications (Cambridge, England)","2021","57","61","7505","7508","10.1039/d1cc02993b","","","0.71073","MoKα","","0.1034","0.0783","","","0.153","0.1631","","","","","","1.137","","","","has coordinates","268497","2021-09-06","08:53:57",""
"7128579","20.5142","0.0011","11.6374","0.0005","14.3998","0.0007","90","","93.907","0.002","90","","3429.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Morpholine Addukt","Morpholine Addukt","","- C34 H60 Al N O3 -","- C34 H60 Al N O3 -","- C136 H240 Al4 N4 O12 -","4","1","","Drescher, Regina; Ritschel, Benedikt; Dewhurst, Rian D.; Deißenberger, Andrea; Hofmann, Alexander; Braunschweig, Holger","Synthesis of novel six-, seven- and eight-membered aluminum-containing rings by alumole ring expansion.","Chemical communications (Cambridge, England)","2021","57","61","7505","7508","10.1039/d1cc02993b","","","0.71073","MoKα","","0.0769","0.063","","","0.1451","0.1539","","","","","","1.062","","","","has coordinates,has disorder","268497","2021-09-06","08:54:00",""
"7128580","10.154","0.004","35.675","0.014","10.784","0.004","90","","111.84","0.009","90","","3626","2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Nitrone","Nitrone","","- C42 H60 Al N O -","- C42 H60 Al N O -","- C168 H240 Al4 N4 O4 -","4","1","","Drescher, Regina; Ritschel, Benedikt; Dewhurst, Rian D.; Deißenberger, Andrea; Hofmann, Alexander; Braunschweig, Holger","Synthesis of novel six-, seven- and eight-membered aluminum-containing rings by alumole ring expansion.","Chemical communications (Cambridge, England)","2021","57","61","7505","7508","10.1039/d1cc02993b","","","0.71073","MoKα","","0.0814","0.0505","","","0.1079","0.1204","","","","","","1.05","","","","has coordinates","268497","2021-09-06","08:54:09",""
"7128581","8.982","0.005","13.786","0.005","13.975","0.003","112.81","0.03","107.33","0.03","96.28","0.03","1472.2","1.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H13 F2 N O -","- C19 H13 F2 N O -","- C76 H52 F8 N4 O4 -","4","2","","Hu, Xiao; Ding, Aishun; Xu, Dawen; Guo, Hao","Visible light-induced one-pot synthesis of CF<sub>3</sub>/CF<sub>2</sub>-substituted cyclobutene derivatives.","Chemical communications (Cambridge, England)","2021","57","60","7441","7444","10.1039/d1cc02696h","","","1.34138","GaKα","","0.0541","0.0447","","","0.1168","0.125","","","","","","1.06","","","","has coordinates,has disorder","268574","2021-09-06","09:31:22",""
"7128582","25.323","0.002","5.9171","0.0004","25.206","0.002","90","","114.569","0.002","90","","3434.9","0.5","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H15 Br F3 N O -","- C19 H15 Br F3 N O -","- C152 H120 Br8 F24 N8 O8 -","8","1","","Hu, Xiao; Ding, Aishun; Xu, Dawen; Guo, Hao","Visible light-induced one-pot synthesis of CF<sub>3</sub>/CF<sub>2</sub>-substituted cyclobutene derivatives.","Chemical communications (Cambridge, England)","2021","57","60","7441","7444","10.1039/d1cc02696h","","","0.71073","MoKα","","0.095","0.0567","","","0.1066","0.1251","","","","","","1.038","","","","has coordinates","268574","2021-09-06","09:31:22",""
"7128583","9.0542","0.0007","10.087","0.0008","16.9352","0.0014","90","","93.412","0.003","90","","1543.9","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H14 F3 N O -","- C19 H14 F3 N O -","- C76 H56 F12 N4 O4 -","4","1","","Hu, Xiao; Ding, Aishun; Xu, Dawen; Guo, Hao","Visible light-induced one-pot synthesis of CF<sub>3</sub>/CF<sub>2</sub>-substituted cyclobutene derivatives.","Chemical communications (Cambridge, England)","2021","57","60","7441","7444","10.1039/d1cc02696h","","","1.34138","GaKα","","0.0511","0.0457","","","0.1219","0.1276","","","","","","1.024","","","","has coordinates","268574","2021-09-06","09:31:22",""
"7128584","7.6661","0.0019","13.863","0.003","19.578","0.005","90","","90","","90","","2080.7","0.9","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H24 O S -","- C26 H24 O S -","- C104 H96 O4 S4 -","4","1","","Wang, Yuna; Qi, Zaojuan; Niu, Yanning; Feng, Hua; Benassi, Enrico; Qian, Bo","Selective oxidative intermolecular carbosulphenylation of aryl alkenes with thiols and nucleophiles <i>via</i> a 1,2-dithioethane intermediate.","Chemical communications (Cambridge, England)","2021","57","61","7533","7536","10.1039/d1cc02517a","","","0.71073","MoKα","","0.0802","0.0442","","","0.0998","0.1155","","","","","","1","","","","has coordinates","268614","2021-09-06","09:49:04",""
"7128585","11.4056","0.0002","22.818","0.0004","25.3841","0.0005","90","","90","","90","","6606.3","0.2","99.98","0.1","99.98","0.1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C30 H25 Cl2 Fe N4 O2 -","- C30 H25 Cl2 Fe N4 O2 -","- C240 H200 Cl16 Fe8 N32 O16 -","8","1","","Margonis, Caroline M.; Ho, Marissa; Travis, Benjamin D.; Brennessel, William W.; McNamara, William R.","Iron polypyridyl complex adsorbed on carbon surfaces for hydrogen generation.","Chemical communications (Cambridge, England)","2021","57","62","7697","7700","10.1039/d1cc02131a","","x-ray","1.54184","CuKα","","0.0724","0.0556","","","0.1556","0.1695","","","","","","1.049","","","","has coordinates,has disorder","268556","2021-09-06","09:16:49",""
"7128586","9.1579","0.0003","12.3208","0.0005","16.9209","0.0006","68.777","0.001","88.042","0.001","74.787","0.001","1713.44","0.11","150","2","150","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H34 Cl N5 O4 S2 -","- C36 H34 Cl N5 O4 S2 -","- C72 H68 Cl2 N10 O8 S4 -","2","1","","Chen, Li; Huang, Rong; Yun, Xing-Han; Hao, Tian-Hui; Yan, Sheng-Jiao","Multi-component cascade reaction of 3-formylchromones: highly selective synthesis of 4,5-dihydro-[4,5'-bipyrimidin]-6(1H)-one derivatives.","Chemical communications (Cambridge, England)","2021","57","62","7657","7660","10.1039/d1cc02437j","","","1.54178","CuKα","","0.0685","0.0677","","","0.1935","0.1949","","","","","","1.053","","","","has coordinates","268495","2021-09-06","08:52:37",""
"7128587","11.2453","0.0013","11.7271","0.0013","12.9429","0.0016","92.075","0.002","114.267","0.002","104.496","0.002","1487.7","0.3","296.15","","296.15","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H30 F N5 O2.5 -","- C27 H30 F N5 O2.5 -","- C54 H60 F2 N10 O5 -","2","1","","Chen, Li; Huang, Rong; Yun, Xing-Han; Hao, Tian-Hui; Yan, Sheng-Jiao","Multi-component cascade reaction of 3-formylchromones: highly selective synthesis of 4,5-dihydro-[4,5'-bipyrimidin]-6(1H)-one derivatives.","Chemical communications (Cambridge, England)","2021","57","62","7657","7660","10.1039/d1cc02437j","","","0.71073","MoKα","","0.1587","0.0884","","","0.2421","0.3077","","","","","","1.014","","","","has coordinates,has disorder","268495","2021-09-06","08:52:40",""
"7128588","13.5619","0.0004","16.3532","0.0004","39.3827","0.0009","90","","90","","90","","8734.3","0.4","100","","100","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H59 Cl2 Fe N9 O8 -","- C34.0003 H59.0009 Cl2 Fe N9.0003 O8 -","- C272.002 H472.007 Cl16 Fe8 N72.0024 O64 -","8","1","","Song, Seungjin; Lee, Junseong; Choi, Jun-Ho; Seo, Junhyeok","Electrochemical behaviors of a pincer-type NNN-Fe complex and catalytic H<sub>2</sub> evolution activity.","Chemical communications (Cambridge, England)","2021","57","61","7497","7500","10.1039/d1cc03050g","","","0.71073","MoKα","","0.1158","0.057","","","0.1251","0.1541","","","","","","1.005","","","","has coordinates,has disorder","268498","2021-09-06","08:56:08",""
"7128589","10.1604","0.0008","10.197","0.001","11.8624","0.0013","90","","90","","90","","1229","0.2","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","(S)-1-((4-bromophenyl)sulfonyl)-3-fluoropyrrolidine","","- C10 H11 Br F N O2 S -","- C10 H11 Br F N O2 S -","- C40 H44 Br4 F4 N4 O8 S4 -","4","1","","Wang, Xiu; Zhou, Min; Liu, Qinghe; Ni, Chuanfa; Fei, Zhongbo; Li, Wei; Hu, Jinbo","Deoxyfluorination of alcohols with aryl fluorosulfonates.","Chemical communications (Cambridge, England)","2021","57","66","8170","8173","10.1039/d1cc02617h","","","0.71073","MoKα","","0.0654","0.0439","","","0.1073","0.1181","","","","","","1.05","","","","has coordinates","268549","2021-09-06","09:13:43",""
"7128590","6.4512","0.0001","8.5325","0.0002","8.7429","0.0002","91.537","0.002","93.551","0.002","91.604","0.002","479.943","0.017","293","","293","","","","","","","","","4","P 1","P 1","1","","(S,E)-methyl 5-(5-((E)-(2,2-dimethylhydrazono)methyl)-1-methyl-1H-pyrrol-2-yl)-5-phenylpent-2-enoate","","- C20 H25 N3 O2 -","- C20 H25 N3 O2 -","- C20 H25 N3 O2 -","1","1","","Łukasik, Beata; Kowalska, Justyna; Frankowski, Sebastian; Albrecht, Łukasz","Vinylogous hydrazone strategy for the organocatalytic alkylation of heteroaromatic derivatives.","Chemical communications (Cambridge, England)","2021","57","51","6312","6315","10.1039/d1cc01923f","","x-ray","1.54184","CuKα","","0.035","0.0348","","","0.0924","0.0926","","","","","","1.045","","","","has coordinates","266977","2021-07-04","09:32:57",""
"7128591","23.5338","0.0009","17.3277","0.0006","26.3271","0.0009","90","","111.647","0.004","90","","9978.7","0.7","113","","113","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C88 H112 N8 Pd7 Si4 -","- C88 H81 N8 Pd7 Si4 -","- C352 H324 N32 Pd28 Si16 -","4","1","","Shimamoto, Kento; Sunada, Yusuke","Nuclearity expansion in Pd clusters triggered by the migration of a phenyl group in cyclooligosilanes.","Chemical communications (Cambridge, England)","2021","57","62","7649","7652","10.1039/d1cc02682h","","","0.71075","MoKα","","0.1753","0.0662","","","0.1119","0.1451","","","","","","0.951","","","","has coordinates","268500","2021-09-06","08:58:43",""
"7128592","13.6595","0.0003","16.1139","0.0003","20.716","0.0003","84.585","0.0015","80.483","0.0015","79.772","0.0018","4415.59","0.15","296","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C85 H95 N5 O Pd5 Si5 -","- C88.2 H68 N5 O0.8 Pd5 Si5 -","- C176.4 H136 N10 O1.6 Pd10 Si10 -","2","1","","Shimamoto, Kento; Sunada, Yusuke","Nuclearity expansion in Pd clusters triggered by the migration of a phenyl group in cyclooligosilanes.","Chemical communications (Cambridge, England)","2021","57","62","7649","7652","10.1039/d1cc02682h","","","0.71075","MoKα","","0.0482","0.0359","","","0.0905","0.0979","","","","","","0.968","","","","has coordinates","268500","2021-09-06","08:58:44",""
"7128593","16.2926","0.0006","26.0709","0.001","40.5668","0.0015","90","","97.103","0.003","90","","17099","1.1","296","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C78 H94 N8 Pd6 Si4 -","- C83 H58 N7 Pd6 Si4 -","- C664 H464 N56 Pd48 Si32 -","8","1","","Shimamoto, Kento; Sunada, Yusuke","Nuclearity expansion in Pd clusters triggered by the migration of a phenyl group in cyclooligosilanes.","Chemical communications (Cambridge, England)","2021","57","62","7649","7652","10.1039/d1cc02682h","","","0.71075","MoKα","","0.2807","0.0876","","","0.1529","0.217","","","","","","0.962","","","","has coordinates","268500","2021-09-06","08:58:44",""
"7128594","14.0947","0.0002","16.6487","0.0003","23.8355","0.0003","88.208","0.0013","81.288","0.0013","81.87","0.0013","5472.83","0.15","296","","296","","","","","","","","","5","P -1","-P 1","2","","","","- C95 H113 N7 Pd7 Si5 -","- C98.5 H104 N7 Pd7 Si5 -","- C197 H208 N14 Pd14 Si10 -","2","1","","Shimamoto, Kento; Sunada, Yusuke","Nuclearity expansion in Pd clusters triggered by the migration of a phenyl group in cyclooligosilanes.","Chemical communications (Cambridge, England)","2021","57","62","7649","7652","10.1039/d1cc02682h","","","0.71075","MoKα","","0.062","0.0365","","","0.0856","0.0954","","","","","","0.983","","","","has coordinates","268500","2021-09-06","08:58:44",""
"7128595","18.644","0.004","9.1535","0.0018","20.027","0.004","90","","90","","90","","3417.8","1.2","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H19 F N2 O2 S -","- C18 H19 F N2 O2 S -","- C144 H152 F8 N16 O16 S8 -","8","1","","Riley, William; Jones, Andrew C.; Singh, Kuldip; Browne, Duncan L.; Stuart, Alison M.","Accessing novel fluorinated heterocycles with the hypervalent fluoroiodane reagent by solution and mechanochemical synthesis.","Chemical communications (Cambridge, England)","2021","57","60","7406","7409","10.1039/d1cc02587b","","","0.71073","MoKα","","0.0859","0.0511","","","0.1005","0.1105","","","","","","0.958","","","","has coordinates","268577","2021-09-06","09:31:58",""
"7128596","8.315","0.003","11.835","0.005","16.239","0.006","90","","90","","90","","1598","1.1","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H21 F N2 O2 S -","- C15 H21 F N2 O2 S -","- C60 H84 F4 N8 O8 S4 -","4","1","","Riley, William; Jones, Andrew C.; Singh, Kuldip; Browne, Duncan L.; Stuart, Alison M.","Accessing novel fluorinated heterocycles with the hypervalent fluoroiodane reagent by solution and mechanochemical synthesis.","Chemical communications (Cambridge, England)","2021","57","60","7406","7409","10.1039/d1cc02587b","","","0.71073","MoKα","","0.0607","0.0497","","","0.1054","0.1101","","","","","","1.072","","","","has coordinates","268577","2021-09-06","09:31:58",""
"7128597","20.185","0.003","20.185","0.003","21.625","0.005","90","","90","","120","","7630","2","150","2","150","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C16 H17 F N2 O2 S2 -","- C16 H17 F N2 O2 S2 -","- C288 H306 F18 N36 O36 S36 -","18","1","","Riley, William; Jones, Andrew C.; Singh, Kuldip; Browne, Duncan L.; Stuart, Alison M.","Accessing novel fluorinated heterocycles with the hypervalent fluoroiodane reagent by solution and mechanochemical synthesis.","Chemical communications (Cambridge, England)","2021","57","60","7406","7409","10.1039/d1cc02587b","","","0.71073","MoKα","","0.0934","0.0546","","","0.1106","0.1225","","","","","","0.974","","","","has coordinates","268577","2021-09-06","09:31:58",""
"7128598","9.348","0.005","8.856","0.005","25.174","0.013","90","","90","","90","","2084.1","1.9","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H14 F N O -","- C12 H14 F N O -","- C96 H112 F8 N8 O8 -","8","1","","Riley, William; Jones, Andrew C.; Singh, Kuldip; Browne, Duncan L.; Stuart, Alison M.","Accessing novel fluorinated heterocycles with the hypervalent fluoroiodane reagent by solution and mechanochemical synthesis.","Chemical communications (Cambridge, England)","2021","57","60","7406","7409","10.1039/d1cc02587b","","","0.71073","MoKα","","0.0782","0.0594","","","0.1462","0.1565","","","","","","0.99","","","","has coordinates","268577","2021-09-06","09:31:58",""
"7128599","11.028","0.003","9.215","0.003","17.393","0.005","90","","98.322","0.005","90","","1748.9","0.9","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 Cl F N2 O2 S -","- C18 H18 Cl F N2 O2 S -","- C72 H72 Cl4 F4 N8 O8 S4 -","4","1","","Riley, William; Jones, Andrew C.; Singh, Kuldip; Browne, Duncan L.; Stuart, Alison M.","Accessing novel fluorinated heterocycles with the hypervalent fluoroiodane reagent by solution and mechanochemical synthesis.","Chemical communications (Cambridge, England)","2021","57","60","7406","7409","10.1039/d1cc02587b","","","0.71073","MoKα","","0.0515","0.0433","","","0.104","0.1081","","","","","","1.038","","","","has coordinates","268577","2021-09-06","09:31:58",""
"7128600","9.503","0.006","9.161","0.006","24.001","0.015","90","","90","","90","","2089","2","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C11 H11 Cl F N O -","- C11 H11 Cl F N O -","- C88 H88 Cl8 F8 N8 O8 -","8","1","","Riley, William; Jones, Andrew C.; Singh, Kuldip; Browne, Duncan L.; Stuart, Alison M.","Accessing novel fluorinated heterocycles with the hypervalent fluoroiodane reagent by solution and mechanochemical synthesis.","Chemical communications (Cambridge, England)","2021","57","60","7406","7409","10.1039/d1cc02587b","","","0.71073","MoKα","","0.1401","0.0865","","","0.1974","0.2267","","","","","","1.037","","","","has coordinates","268577","2021-09-06","09:31:58",""
"7128601","10.7515","0.0007","29.6409","0.0019","25.592","0.0017","90","","99.774","0.001","90","","8037.4","0.9","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[(CpAr)La(CH2-C6H4-Me)2(THF)]","","","- C85 H111 La O -","- C85 H111 La O -","- C340 H444 La4 O4 -","4","1","","Wang, Yang; Del Rosal, Iker; Qin, Guorui; Zhao, Lanxiao; Maron, Laurent; Shi, Xianghui; Cheng, Jianhua","Scandium and lanthanum hydride complexes stabilized by super-bulky penta-arylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","63","7766","7769","10.1039/d1cc01841h","","","0.71073","MoKα","","0.0557","0.0432","","","0.1079","0.1156","","","","","","1.041","","","","has coordinates,has disorder","268523","2021-09-06","09:08:04",""
"7128602","16.5086","0.0013","26.3426","0.0019","15.7814","0.0012","90","","114.871","0.001","90","","6226.5","0.8","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[(CpAr)Sc(H)(OBu)]2","","","- C69 H95 O Sc -","- C69 H95 O Sc -","- C276 H380 O4 Sc4 -","4","1","","Wang, Yang; Del Rosal, Iker; Qin, Guorui; Zhao, Lanxiao; Maron, Laurent; Shi, Xianghui; Cheng, Jianhua","Scandium and lanthanum hydride complexes stabilized by super-bulky penta-arylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","63","7766","7769","10.1039/d1cc01841h","","","0.71073","MoKα","","0.1375","0.0827","","","0.2029","0.2406","","","","","","1.023","","","","has coordinates,has disorder","268523","2021-09-06","09:08:07",""
"7128603","20.0516","0.0005","19.8615","0.0005","31.0309","0.0008","90","","93.752","0.001","90","","12331.7","0.5","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","[(CpAr)LaH]2","","","- C130 H172 La2 -","- C130 H172 La2 -","- C520 H688 La8 -","4","1","","Wang, Yang; Del Rosal, Iker; Qin, Guorui; Zhao, Lanxiao; Maron, Laurent; Shi, Xianghui; Cheng, Jianhua","Scandium and lanthanum hydride complexes stabilized by super-bulky penta-arylcyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2021","57","63","7766","7769","10.1039/d1cc01841h","","","0.71073","MoKα","","0.0716","0.0501","","","0.1312","0.1463","","","","","","1.038","","","","has coordinates,has disorder","268523","2021-09-06","09:08:09",""
"7128604","7.5982","0.0015","26.508","0.005","16.115","0.003","90","","99.22","0.03","90","","3203.8","1.1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1","","","- C24 H16 N2 O4 Zn -","- C24 H16 N2 O4 Zn -","- C96 H64 N8 O16 Zn4 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0631","0.0405","","","0.0936","0.104","","","","","","1.02","","","","has coordinates,has disorder","268554","2021-09-06","09:16:15",""
"7128605","7.58","0.003","25.608","0.011","16.702","0.007","90","","97.963","0.01","90","","3211","2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","CoCP_LTphase","","","- C24 H16 Co N2 O4 -","- C24 H16 Co N2 O4 -","- C96 H64 Co4 N8 O16 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0895","0.053","","","0.1333","0.1467","","","","","","1.033","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128606","7.7","0.004","25.487","0.013","17.427","0.008","90","","99.184","0.015","90","","3376","3","270","2","270","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ZnCP_HTphase","","","- C24 H16 N2 O4 Zn -","- C24 H16 N2 O4 Zn -","- C96 H64 N8 O16 Zn4 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0838","0.0514","","","0.1455","0.1662","","","","","","1.01","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128607","7.5011","0.0003","25.9846","0.001","16.5982","0.0007","90","","98.153","0.001","90","","3202.5","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","CdNiCP_LTphase","","","- C24 H16 Cd0.17 N2 Ni0.83 O4 -","- C24 H16 Cd0.17 N2 Ni0.83 O4 -","- C96 H64 Cd0.68 N8 Ni3.32 O16 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0709","0.0628","","","0.15","0.1537","","","","","","1.12","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128608","7.635","0.0009","22.768","0.003","19.177","0.002","90","","94.897","0.002","90","","3321.4","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","CdCP_LTphase","","","- C24 H16 Cd N2 O4 -","- C24 H16 Cd N2 O4 -","- C96 H64 Cd4 N8 O16 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0595","0.0469","","","0.1046","0.1106","","","","","","1.117","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128609","7.6038","0.0004","26.5229","0.0015","16.1227","0.001","90","","99.049","0.002","90","","3211.1","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ZnCdCP_LTphase","","","- C24 H16 Cd0.08 N2 O4 Zn0.92 -","- C24 H16 Cd0.08 N2 O4 Zn0.92 -","- C96 H64 Cd0.32 N8 O16 Zn3.68 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0498","0.0397","","","0.118","0.1238","","","","","","1.09","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128610","7.5873","0.0002","26.0253","0.0009","16.9377","0.0006","90","","99.261","0.001","90","","3300.95","0.19","270","2","270","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","NiCP_HTphase","","","- C24 H16 N2 Ni O4 -","- C24 H16 N2 Ni O4 -","- C96 H64 N8 Ni4 O16 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0511","0.0358","","","0.1004","0.1075","","","","","","1.04","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128611","7.716","0.002","25.819","0.006","17.144","0.004","90","","99.26","0.008","90","","3370.9","1.4","270","2","270","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ZnCoCP_HTphase","","","- C24 H16 Co0.08 N2 O4 Zn0.92 -","- C24 H16 Co0.08 N2 O4 Zn0.92 -","- C96 H64 Co0.32 N8 O16 Zn3.68 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0993","0.0627","","","0.1936","0.2365","","","","","","1.05","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128612","7.6004","0.0002","26.5194","0.0008","16.0294","0.0005","90","","99.211","0.001","90","","3189.19","0.16","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ZnCoCP_LTphase","","","- C24 H16 Co0.08 N2 O4 Zn0.92 -","- C24 H16 Co0.08 N2 O4 Zn0.92 -","- C96 H64 Co0.32 N8 O16 Zn3.68 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0523","0.0415","","","0.1238","0.1311","","","","","","1.055","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128613","7.672","0.005","25.683","0.018","17.291","0.013","90","","98.63","0.02","90","","3368","4","270","2","270","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","CoCP_HTphase","","","- C24 H16 Co N2 O4 -","- C24 H16 Co N2 O4 -","- C96 H64 Co4 N8 O16 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.1014","0.0693","","","0.1754","0.1922","","","","","","1.013","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128614","7.6961","0.0015","28.012","0.006","14.695","0.003","90","","99.713","0.004","90","","3122.6","1.1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","NiCP_LTphase","","","- C24 H16 N2 Ni O4 -","- C24 H16 N2 Ni O4 -","- C96 H64 N8 Ni4 O16 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.1075","0.085","","","0.1952","0.2043","","","","","","1.129","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128615","7.6318","0.0015","26.288","0.006","16.739","0.004","90","","98.895","0.007","90","","3317.9","1.3","270","2","270","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","CdNiCP_HTphase","","","- C24 H16 Cd0.17 N2 Ni0.83 O4 -","- C24 H16 Cd0.17 N2 Ni0.83 O4 -","- C96 H64 Cd0.68 N8 Ni3.32 O16 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0991","0.0694","","","0.1862","0.2036","","","","","","1.038","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128616","7.6964","0.0005","25.4608","0.0019","17.4291","0.0013","90","","99.016","0.002","90","","3373.1","0.4","270","2","270","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ZnCdCP_HTphase","","","- C24 H16 Cd0.08 N2 O4 Zn0.92 -","- C24 H16 Cd0.08 N2 O4 Zn0.92 -","- C96 H64 Cd0.32 N8 O16 Zn3.68 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0617","0.0461","","","0.1314","0.1423","","","","","","1.032","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128617","7.751","0.0004","23.7727","0.0016","19.0443","0.0012","90","","96.398","0.002","90","","3487.3","0.4","270","2","270","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","CdCP_HTphase","","","- C24 H16 Cd N2 O4 -","- C24 H16 Cd N2 O4 -","- C96 H64 Cd4 N8 O16 -","4","1","","van Wyk, Lisa M.; Loots, Leigh; Barbour, Leonard J.","Tuning extreme anisotropic thermal expansion in 1D coordination polymers through metal selection and solid solutions.","Chemical communications (Cambridge, England)","2021","57","62","7693","7696","10.1039/d1cc01717a","","","0.71073","MoKα","","0.0728","0.041","","","0.0991","0.1161","","","","","","1.016","","","","has coordinates,has disorder","268554","2021-09-06","09:16:16",""
"7128618","16.2776","0.0007","16.2776","0.0007","17.752","0.0009","90","","90","","90","","4703.6","0.4","293","2","293","2","","","","","","","","5","I 4/m","-I 4","87","","","","- H48 N12 O78 Sb8 V30 -","- H32 N12 O78 Sb8 V30 -","- H64 N24 O156 Sb16 V60 -","2","0.125","","Lühmann, Henning; Näther, Christian; van Leusen, Jan; Kögerler, Paul; Bensch, Wolfgang","Three intersecting {V<sub>12</sub>} rings: {V<sub>30</sub>Sb<sub>8</sub>}, an ultra-large polyoxovanadate cluster shell.","Chemical communications (Cambridge, England)","2021","57","62","7661","7664","10.1039/d1cc03028k","","","0.71073","MoKα","","0.0618","0.0415","","","0.0991","0.1072","","","","","","1.034","","","","has coordinates","268553","2021-09-06","09:15:21",""
"7128619","24.7464","0.0009","8.0186","0.0003","23.0495","0.0009","90","","104.533","0.0019","90","","4427.4","0.3","130","0.5","130","0.5","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C28 H24 N4 O3 -","- C28 H24 N4 O3 -","- C224 H192 N32 O24 -","8","2","","Vygranenko, Kateryna V.; Poronik, Yevgen M.; Wrzosek, Antoni; Szewczyk, Adam; Gryko, Daniel T.","Red emissive sulfone-rhodols as mitochondrial imaging agents.","Chemical communications (Cambridge, England)","2021","57","63","7782","7785","10.1039/d1cc02687a","","","1.54178","CuKα","","0.1245","0.0977","","","0.2932","0.3189","","","","","","1.214","","","","has coordinates,has disorder","268524","2021-09-06","09:08:22",""
"7128620","23.6852","0.0007","10.0753","0.0003","21.4888","0.0005","90","","123.376","0.001","90","","4282.3","0.2","200","","200","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H19 N O5 S2 -","- C24 H19 N O5 S2 -","- C192 H152 N8 O40 S16 -","8","1","","Cheng, Bin; Li, Hui; Zhu, Xuecheng; Zhang, Xinping; He, Yixuan; Sun, Haiyan; Wang, Taimin; Zhai, Hongbin","Diversity-oriented synthesis of benzofuro[3,2-b]pyridine derivatives from aurone-derived α,β-unsaturated imines and activated terminal alkynes.","Chemical communications (Cambridge, England)","2021","57","62","7701","7704","10.1039/d1cc02477a","","","0.71073","MoKα","","0.0659","0.0459","","","0.1055","0.1188","","","","","","1.045","","","","has coordinates","268499","2021-09-06","08:57:42",""
"7128621","11.3915","0.0005","11.6757","0.0004","12.0576","0.0005","70.795","0.002","64.171","0.001","74.407","0.002","1348.22","0.1","270","","270","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H25 N O7 S -","- C30 H25 N O7 S -","- C60 H50 N2 O14 S2 -","2","1","","Cheng, Bin; Li, Hui; Zhu, Xuecheng; Zhang, Xinping; He, Yixuan; Sun, Haiyan; Wang, Taimin; Zhai, Hongbin","Diversity-oriented synthesis of benzofuro[3,2-b]pyridine derivatives from aurone-derived α,β-unsaturated imines and activated terminal alkynes.","Chemical communications (Cambridge, England)","2021","57","62","7701","7704","10.1039/d1cc02477a","","","0.71073","MoKα","","0.0584","0.0456","","","0.1117","0.1242","","","","","","1.039","","","","has coordinates","268499","2021-09-06","08:57:42",""
"7128622","16.1033","0.0009","8.4274","0.0005","34.064","0.003","90","","90","","90","","4622.8","0.6","150","0.1","150","0.1","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C52 H42 N2 O6 -","- C52 H42 N2 O6 -","- C208 H168 N8 O24 -","4","1","","Yang, Xin; Yan, Yongkun; Zeng, Weixuan; Song, Ying; Li, Wenhao; Zhao, Lingli; Zhao, Yan; Chen, Huajie; Liu, Yunqi","Bis-acenaphthoquinone diimides with high electron deficiency and good coplanar conformation.","Chemical communications (Cambridge, England)","2021","57","63","7822","7825","10.1039/d1cc02693c","","x-ray","1.54184","CuKα","","0.0986","0.0859","","","0.2261","0.2443","","","","","","1.03","","","","has coordinates,has disorder","268522","2021-09-06","09:07:37",""
"7128623","9.827","0.0009","12.6308","0.001","19.5062","0.0018","90","","100.309","0.003","90","","2382.1","0.4","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H27 Dy N4 O6 -","- C20 H27 Dy N4 O6 -","- C80 H108 Dy4 N16 O24 -","4","1","","Kitos, Alexandros A.; Gálico, Diogo A; Mavragani, Niki; Castañeda, Raúl; Moilanen, Jani O.; Brusso, Jaclyn L.; Murugesu, Muralee","Probing optical and magnetic properties <i>via</i> subtle stereoelectronic effects in mononuclear Dy<sup>III</sup>-complexes.","Chemical communications (Cambridge, England)","2021","57","63","7818","7821","10.1039/d1cc02407h","","","0.71073","MoKα","","0.0436","0.03","","","0.0633","0.0697","","","","","","1.044","","","","has coordinates","268521","2021-09-06","09:07:23",""
"7128624","7.6486","0.0003","6.0185","0.0002","15.9086","0.0006","90","","103.605","0.001","90","","711.77","0.05","125","2","125","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H15 N3 O3 -","- C16 H15 N3 O3 -","- C32 H30 N6 O6 -","2","1","","Zhao, Yunbo; Mandal, Dipendu; Guo, Jing; Wu, Yile; Stephan, Douglas W.","B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub>-Catalyzed site-selective <i>N</i><sup>1</sup>-alkylation of benzotriazoles with diazoalkanes.","Chemical communications (Cambridge, England)","2021","57","63","7758","7761","10.1039/d1cc03048e","","","1.54178","CuKα","","0.0391","0.0384","","","0.1014","0.1022","","","","","","1.069","","","","has coordinates","268526","2021-09-06","09:08:35",""
"7128625","8.3197","0.0006","10.9741","0.0008","13.6352","0.001","78.261","0.003","82.173","0.003","68.054","0.003","1128.07","0.14","161","","161","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H5 B F15 N3 -","- C24 H5 B F15 N3 -","- C48 H10 B2 F30 N6 -","2","1","","Zhao, Yunbo; Mandal, Dipendu; Guo, Jing; Wu, Yile; Stephan, Douglas W.","B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub>-Catalyzed site-selective <i>N</i><sup>1</sup>-alkylation of benzotriazoles with diazoalkanes.","Chemical communications (Cambridge, England)","2021","57","63","7758","7761","10.1039/d1cc03048e","","","1.54178","CuKα","","0.0477","0.0367","","","0.1","0.1058","","","","","","1.059","","","","has coordinates","268526","2021-09-06","09:08:35",""
"7128626","8.9001","0.0006","13.1997","0.0009","13.3554","0.0009","99.4474","0.0009","97.4134","0.001","105.281","0.0009","1468.3","0.17","200","2","200","2","","","","","","","","7","P -1","-P 1","2","co-crystal 2","","","- C30 H14 F6 I3 N O P -","- C30 H14 F6 I3 N O P -","- C60 H28 F12 I6 N2 O2 P2 -","2","1","","Romero-Nieto, Carlos; de Cózar, A; Regulska, Elzbieta; Mullenix, John B.; Rominger, Frank; Hindenberg, Philip","Controlling the molecular arrangement of racemates through weak interactions: the synergy between π-interactions and halogen bonds.","Chemical communications (Cambridge, England)","2021","57","60","7366","7369","10.1039/d1cc01700d","","","0.71073","MoKα","","0.0314","0.0231","","","0.0482","0.0514","","","","","","1.017","","","","has coordinates","268575","2021-09-06","09:31:37",""
"7128627","7.4617","0.0007","9.0098","0.0008","23.284","0.002","90","","90","","90","","1565.3","0.2","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","compound1","","","- C21 H14 N O P -","- C21 H14 N O P -","- C84 H56 N4 O4 P4 -","4","1","","Romero-Nieto, Carlos; de Cózar, A; Regulska, Elzbieta; Mullenix, John B.; Rominger, Frank; Hindenberg, Philip","Controlling the molecular arrangement of racemates through weak interactions: the synergy between π-interactions and halogen bonds.","Chemical communications (Cambridge, England)","2021","57","60","7366","7369","10.1039/d1cc01700d","","","0.71073","MoKα","","0.1325","0.0714","","","0.1245","0.1458","","","","","","1","","","","has coordinates","268575","2021-09-06","09:31:38",""
"7128628","10.217","0.0004","10.7286","0.0004","13.1032","0.0005","85.5466","0.0009","72.5399","0.0009","64.1678","0.0008","1230.85","0.08","200","2","200","2","","","","","","","","7","P -1","-P 1","2","co-crystal 1","","","- C27 H14 F4 I2 N O P -","- C27 H14 F4 I2 N O P -","- C54 H28 F8 I4 N2 O2 P2 -","2","1","","Romero-Nieto, Carlos; de Cózar, A; Regulska, Elzbieta; Mullenix, John B.; Rominger, Frank; Hindenberg, Philip","Controlling the molecular arrangement of racemates through weak interactions: the synergy between π-interactions and halogen bonds.","Chemical communications (Cambridge, England)","2021","57","60","7366","7369","10.1039/d1cc01700d","","","0.71073","MoKα","","0.0374","0.0254","","","0.0512","0.0552","","","","","","1.029","","","","has coordinates","268575","2021-09-06","09:31:38",""
"7128629","7.44","0.03","11.17","0.04","6.3","0.02","90","","90","","90","","524","3","296","2","296","2","","","","","","","","4","A m m 2","A 2 -2","38","","","","- Ag5 Cl2 P S4 -","- Ag5 Cl2 P S4 -","- Ag10 Cl4 P2 S8 -","2","0.25","","Gao, Lihua; Chu, Yu; Wu, Xiaowen; Zhang, Bingbing; Wu, Kui","From thiophosphate to chalcohalide: mixed-anion AgS<sub>x</sub>Cl<sub>y</sub> ligands concurrently enhancing nonlinear optical effects and laser-damage threshold.","Chemical communications (Cambridge, England)","2021","57","66","8218","8221","10.1039/d1cc02656a","","","0.71073","MoKα","","0.0623","0.0513","","","0.1515","0.1697","","","","","","1.179","","","","has coordinates","268548","2021-09-06","09:13:36",""
"7128630","14.0255","0.0007","16.7687","0.0009","21.8639","0.0015","90","","90","","90","","5142.2","0.5","180","2","180","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C26 H41 O2 Y -","- C26 H41 O2 Y -","- C208 H328 O16 Y8 -","8","1","","Bonath, Martin; Birkelbach, Verena M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Rare-earth-metallocene alkylaluminates trigger distinct tetrahydrofuran activation.","Chemical communications (Cambridge, England)","2021","57","64","7918","7921","10.1039/d1cc03024h","","","0.71073","MoKα","","0.0627","0.0341","","","0.0714","0.0809","","","","","","1.006","","","","has coordinates,has disorder","268538","2021-09-06","09:10:48",""
"7128631","18.808","0.016","8.677","0.007","19.029","0.016","90","","113.609","0.011","90","","2846","4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H50 Al La O -","- C28 H50 Al La O -","- C112 H200 Al4 La4 O4 -","4","1","","Bonath, Martin; Birkelbach, Verena M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Rare-earth-metallocene alkylaluminates trigger distinct tetrahydrofuran activation.","Chemical communications (Cambridge, England)","2021","57","64","7918","7921","10.1039/d1cc03024h","","","0.71073","MoKα","","0.042","0.0274","","","0.0521","0.0553","","","","","","0.935","","","","has coordinates","268538","2021-09-06","09:10:49",""
"7128632","16.6514","0.0015","15.0366","0.0013","11.0355","0.001","90","","90","","90","","2763.1","0.4","136","2","136","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C27 H46 Al La O -","- C27 H46 Al La O -","- C108 H184 Al4 La4 O4 -","4","0.5","","Bonath, Martin; Birkelbach, Verena M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Rare-earth-metallocene alkylaluminates trigger distinct tetrahydrofuran activation.","Chemical communications (Cambridge, England)","2021","57","64","7918","7921","10.1039/d1cc03024h","","","0.71073","MoKα","","0.0289","0.025","","","0.0576","0.0596","","","","","","1.055","","","","has coordinates,has disorder","268538","2021-09-06","09:10:49",""
"7128633","10.5384","0.0002","19.7009","0.0004","11.5448","0.0002","90","","97.1483","0.001","90","","2378.25","0.08","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H41 O Y -","- C26 H41 O Y -","- C104 H164 O4 Y4 -","4","1","","Bonath, Martin; Birkelbach, Verena M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Rare-earth-metallocene alkylaluminates trigger distinct tetrahydrofuran activation.","Chemical communications (Cambridge, England)","2021","57","64","7918","7921","10.1039/d1cc03024h","","","0.71073","MoKα","","0.033","0.0291","","","0.0651","0.0662","","","","","","1.123","","","","has coordinates,has disorder","268538","2021-09-06","09:10:49",""
"7128634","28.5568","0.0017","28.5568","0.0017","28.6245","0.0015","90","","90","","90","","23343","2","100.01","0.11","100.01","0.11","","","","","","","","5","I 4/m","-I 4","87","","","","- C264 H224 N76 O36 Pd6 -","- C264 H224 N76 O36 Pd6 -","- C528 H448 N152 O72 Pd12 -","2","0.125","","Li, Wen-Yan; Zhao, Chao-Wei; Zhang, Yue-Feng; Guan, Qun; Wan, Jing-Jing; Ma, Jian-Ping; Li, Yan-An; Dong, Yu-Bin","A metal-organic cage-based nanoagent for enhanced photodynamic antitumor therapy.","Chemical communications (Cambridge, England)","2021","57","64","7954","7957","10.1039/d1cc02629a","","x-ray","1.54178","CuKα","","0.1546","0.1005","","","0.2901","0.3516","","","","","","1.057","","","","has coordinates,has disorder","268533","2021-09-06","09:09:54",""
"7128635","8.8163","0.0003","11.2961","0.0004","12.0369","0.0004","107.789","0.002","95.854","0.002","110.117","0.002","1042.66","0.07","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C27 H21 Cl O3 -","- C27 H21 Cl O3 -","- C54 H42 Cl2 O6 -","2","2","","Ghosh, Arghya; Barik, Shilpa; Shee, Sayan; Biju, Akkattu T.","Enantioselective synthesis of tetra-substituted tetralines and tetrahydro-indolizines by NHC-catalyzed azolium-enolate cascade.","Chemical communications (Cambridge, England)","2021","57","63","7794","7797","10.1039/d1cc03165a","","","0.71073","MoKα","","0.1051","0.0572","","","0.1141","0.1353","","","","","","0.978","","","","has coordinates","268525","2021-09-06","09:08:29",""
"7128636","8.6836","0.0012","9.4176","0.0013","19.321","0.003","83.076","0.003","83.623","0.003","89.078","0.003","1558.8","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H17 F3 N2 O2 -","- C15 H17 F3 N2 O2 -","- C60 H68 F12 N8 O8 -","4","2","","Sun, Xi-Shang; Chang, Xin; Shi, Li-Min; Wang, Zuo-Fei; Wei, Liang; Wang, Chun-Jiang","Palladium catalyzed cascade umpolung allylation/acetalation for the construction of quaternary 3-amino oxindoles.","Chemical communications (Cambridge, England)","2021","57","64","7958","7961","10.1039/d1cc03075b","","","0.71073","MoKα","","0.1089","0.062","","","0.1591","0.1864","","","","","","1.019","","","","has coordinates,has disorder","268529","2021-09-06","09:09:13",""
"7128637","8.4111","0.0016","8.4111","0.0016","8.4111","0.0016","90","","90","","90","","595.1","0.2","","","","","","","","","","","","3","I 21 3","I 2b 2c 3","199","","","","- Bi2 Pt3 S2 -","- Bi2 Pt3 S2 -","- Bi8 Pt12 S8 -","4","0.166667","","Fang, Yuqiang; Wang, Sishun; Lin, Gaoxin; Wang, Xin; Huang, Fuqiang","A new compound Pt<sub>3</sub>Bi<sub>2</sub>S<sub>2</sub> with superior performance for the hydrogen evolution reaction.","Chemical communications (Cambridge, England)","2021","57","64","7946","7949","10.1039/d1cc02741g","","","","","","0.012","","","","","","","","","","","","","","","has coordinates","268528","2021-09-06","09:09:07",""
"7128638","55.5617","0.0014","14.4627","0.0002","24.0687","0.0006","90","","117.802","0.003","90","","17108.3","0.8","123","2","123","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C33 H74 Cl2 Mo9 N2 O41 P V4 -","- C33 H74 Cl2 Mo9 N2 O41 P V4 -","- C264 H592 Cl16 Mo72 N16 O328 P8 V32 -","8","1","","Li, Chifeng; Yamaguchi, Kazuya; Suzuki, Kosuke","Synthesis of a phosphomolybdate with a tetranuclear vanadium core by installing vanadium atoms in a lacunary template using the protecting group strategy.","Chemical communications (Cambridge, England)","2021","57","64","7882","7885","10.1039/d1cc03099j","","","0.71073","MoKα","","0.1177","0.0777","","","0.1682","0.1867","","","","","","1.012","","","","has coordinates","268536","2021-09-06","09:10:25",""
"7128639","17.0243","0.0001","11.2874","0.0001","19.846","0.0002","90","","90.53","0.001","90","","3813.45","0.06","99.99","0.1","99.99","0.1","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C41 H31 Br N2 O3 -","- C41 H31 Br N2 O3 -","- C164 H124 Br4 N8 O12 -","4","1","","Yuan, Haoxuan; Hong, Kemiao; Liu, Xiangrong; Qian, Yu; Xu, Xinfang; Hu, Wenhao","Enantioselective assembly of 3,3-disubstituted succinimides <i>via</i> three-component reaction of vinyl diazosuccinimides with alcohols and imines.","Chemical communications (Cambridge, England)","2021","57","65","8043","8046","10.1039/d1cc02876f","","x-ray","1.54184","CuKα","","0.0556","0.0545","","","0.1491","0.1502","","","","","","1.066","","","","has coordinates","268569","2021-09-06","09:30:11",""
"7128640","8.4292","0.0001","17.2642","0.0001","22.5485","0.0002","90","","90","","90","","3281.33","0.05","100","0.1","100","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H27 Br3 N2 O3 -","- C37 H27 Br3 N2 O3 -","- C148 H108 Br12 N8 O12 -","4","1","","Yuan, Haoxuan; Hong, Kemiao; Liu, Xiangrong; Qian, Yu; Xu, Xinfang; Hu, Wenhao","Enantioselective assembly of 3,3-disubstituted succinimides <i>via</i> three-component reaction of vinyl diazosuccinimides with alcohols and imines.","Chemical communications (Cambridge, England)","2021","57","65","8043","8046","10.1039/d1cc02876f","","x-ray","1.54184","CuKα","","0.0344","0.032","","","0.0728","0.0741","","","","","","1.067","","","","has coordinates","268569","2021-09-06","09:30:11",""
"7128641","10.965","0.0003","11.361","0.0003","14.1758","0.0004","75.957","0.002","68.82","0.003","62.077","0.003","1449.14","0.08","100.01","0.1","100.01","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C35 H37 Ir P -","- C35 H37 Ir P -","- C70 H74 Ir2 P2 -","2","1","","Chan, Antony P. Y.; Jakoobi, Martin; Wang, Chenxu; Tian, Yancong; Halcovitch, Nathan; Boulatov, Roman; Sergeev, Alexey G.","Selective, radical-free activation of benzylic C-H bonds in methylarenes.","Chemical communications (Cambridge, England)","2021","57","64","7894","7897","10.1039/d1cc03445f","","x-ray","1.54184","CuKα","","0.0179","0.0174","","","0.0483","0.0486","","","","","","1.043","","","","has coordinates","268534","2021-09-06","09:10:01",""
"7128642","9.7485","0.0005","13.2735","0.0005","18.4175","0.001","90","","104.528","0.005","90","","2307","0.2","220.01","0.1","220.01","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H36 Cl3 N Sn -","- C16 H36 Cl3 N Sn -","- C64 H144 Cl12 N4 Sn4 -","4","1","","Peng, Hui; Wang, Xinxin; Zhang, Zhenheng; Tian, Ye; Xiao, Yonghao; Hu, Jinming; Wang, Jianping; Zou, Bingsuo","Bulk assembly of a 0D organic tin(ii)chloride hybrid with high anti-water stability.","Chemical communications (Cambridge, England)","2021","57","66","8162","8165","10.1039/d1cc02814f","","x-ray","0.71073","MoKα","","0.1087","0.0742","","","0.2097","0.2304","","","","","","1.087","","","","has coordinates,has disorder","268551","2021-09-06","09:14:18",""
"7128643","25.134","0.002","7.8986","0.0006","30.55","0.002","90","","91.564","0.004","90","","6062.6","0.8","301","2","301","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C35 H27.5 N2 O1.75 -","- C35 H26 N2 O1.75 -","- C280 H208 N16 O14 -","8","1","","Lyu, Hairong; Quan, Yangjian; Cheng, Biao; Xie, Zuowei","Rhodium catalyzed multicomponent dehydrogenative annulation: one-step construction of isoindole derivatives.","Chemical communications (Cambridge, England)","2021","57","64","7930","7933","10.1039/d1cc03424c","","","0.71073","MoKα","","0.1289","0.0826","","","0.2568","0.2952","","","","","","1.081","","","","has coordinates","268532","2021-09-06","09:09:43",""
"7128644","6.8971","0.0003","17.6628","0.0007","20.2921","0.0008","90","","91.795","0.002","90","","2470.81","0.18","180","2","180","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H12 B F9 N2 -","- C29 H12 B F9 N2 -","- C116 H48 B4 F36 N8 -","4","1","","Liao, Guanming; Zhang, Jia; Zheng, Xiaoyan; Jia, Xiaodi; Xu, Jialiang; Zhao, Fenggui; Wang, Nan; Liu, Kanglei; Chen, Pangkuan; Yin, Xiaodong","Crystallization-induced emission enhancement of highly electron-deficient dicyanomethylene-bridged triarylboranes.","Chemical communications (Cambridge, England)","2021","57","64","7926","7929","10.1039/d1cc03311e","","","0.71073","MoKα","","0.0769","0.0441","","","0.1022","0.1172","","","","","","1.037","","","","has coordinates,has disorder","268527","2021-09-06","09:09:00",""
"7128645","7.0142","0.0003","17.7383","0.0006","20.3579","0.0006","90","","91.096","0.003","90","","2532.47","0.16","299.99","0.13","299.99","0.13","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H12 B F9 N2 -","- C29 H12 B F9 N2 -","- C116 H48 B4 F36 N8 -","4","1","","Liao, Guanming; Zhang, Jia; Zheng, Xiaoyan; Jia, Xiaodi; Xu, Jialiang; Zhao, Fenggui; Wang, Nan; Liu, Kanglei; Chen, Pangkuan; Yin, Xiaodong","Crystallization-induced emission enhancement of highly electron-deficient dicyanomethylene-bridged triarylboranes.","Chemical communications (Cambridge, England)","2021","57","64","7926","7929","10.1039/d1cc03311e","","x-ray","1.54184","CuKα","","0.1004","0.0548","","","0.1293","0.1608","","","","","","1.029","","","","has coordinates,has disorder","268527","2021-09-06","09:09:00",""
"7128646","17.458","0.008","8.246","0.003","30.523","0.011","90","","95.837","0.014","90","","4371","3","180","2","180","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H14 B F9 -","- C26 H14 B F9 -","- C208 H112 B8 F72 -","8","1","","Liao, Guanming; Zhang, Jia; Zheng, Xiaoyan; Jia, Xiaodi; Xu, Jialiang; Zhao, Fenggui; Wang, Nan; Liu, Kanglei; Chen, Pangkuan; Yin, Xiaodong","Crystallization-induced emission enhancement of highly electron-deficient dicyanomethylene-bridged triarylboranes.","Chemical communications (Cambridge, England)","2021","57","64","7926","7929","10.1039/d1cc03311e","","","0.71073","MoKα","","0.0963","0.0545","","","0.1333","0.1549","","","","","","1.029","","","","has coordinates,has disorder","268527","2021-09-06","09:09:00",""
"7128647","7.1478","0.0004","17.7447","0.001","20.423","0.0016","90","","83","","90","","2571.1","0.3","400","","400","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H12 B F9 N2 -","- C29 H12 B F9 N2 -","- C116 H48 B4 F36 N8 -","4","1","","Liao, Guanming; Zhang, Jia; Zheng, Xiaoyan; Jia, Xiaodi; Xu, Jialiang; Zhao, Fenggui; Wang, Nan; Liu, Kanglei; Chen, Pangkuan; Yin, Xiaodong","Crystallization-induced emission enhancement of highly electron-deficient dicyanomethylene-bridged triarylboranes.","Chemical communications (Cambridge, England)","2021","57","64","7926","7929","10.1039/d1cc03311e","","","1.54184","CuKα","","0.0919","0.0647","","","0.1458","0.157","","","","","","0.878","","","","has coordinates,has disorder","268527","2021-09-06","09:09:00",""
"7128648","8.2738","0.0005","8.7041","0.0006","15.689","0.001","85.63","0.003","77.392","0.002","77.652","0.003","1076.59","0.12","180","2","180","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H12 B F9 O -","- C26 H12 B F9 O -","- C52 H24 B2 F18 O2 -","2","1","","Liao, Guanming; Zhang, Jia; Zheng, Xiaoyan; Jia, Xiaodi; Xu, Jialiang; Zhao, Fenggui; Wang, Nan; Liu, Kanglei; Chen, Pangkuan; Yin, Xiaodong","Crystallization-induced emission enhancement of highly electron-deficient dicyanomethylene-bridged triarylboranes.","Chemical communications (Cambridge, England)","2021","57","64","7926","7929","10.1039/d1cc03311e","","","0.71073","MoKα","","0.1098","0.0546","","","0.1265","0.1475","","","","","","1.058","","","","has coordinates,has disorder","268527","2021-09-06","09:09:00",""
"7128649","34.0175","0.0005","10.2599","0.0001","43.7874","0.0006","90","","102.447","0.001","90","","14923.3","0.3","170","0.13","170","0.13","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C29 H12 B F9 N2 -","- C29 H12 B F9 N2 -","- C696 H288 B24 F216 N48 -","24","3","","Liao, Guanming; Zhang, Jia; Zheng, Xiaoyan; Jia, Xiaodi; Xu, Jialiang; Zhao, Fenggui; Wang, Nan; Liu, Kanglei; Chen, Pangkuan; Yin, Xiaodong","Crystallization-induced emission enhancement of highly electron-deficient dicyanomethylene-bridged triarylboranes.","Chemical communications (Cambridge, England)","2021","57","64","7926","7929","10.1039/d1cc03311e","","x-ray","1.54184","CuKα","","0.0901","0.0613","","","0.1611","0.1808","","","","","","1.044","","","","has coordinates,has disorder","268527","2021-09-06","09:09:00",""
"7128650","8.8732","0.0004","11.496","0.0006","16.2386","0.0009","71.283","0.002","77.713","0.002","89.499","0.002","1529.73","0.14","180","2","180","","","","","","","","","4","P -1","-P 1","2","","","","- C38 H39 B N2 -","- C38 H39 B N2 -","- C76 H78 B2 N4 -","2","1","","Liao, Guanming; Zhang, Jia; Zheng, Xiaoyan; Jia, Xiaodi; Xu, Jialiang; Zhao, Fenggui; Wang, Nan; Liu, Kanglei; Chen, Pangkuan; Yin, Xiaodong","Crystallization-induced emission enhancement of highly electron-deficient dicyanomethylene-bridged triarylboranes.","Chemical communications (Cambridge, England)","2021","57","64","7926","7929","10.1039/d1cc03311e","","","0.71073","MoKα","","0.1052","0.0553","","","0.1307","0.1518","","","","","","1.039","","","","has coordinates","268527","2021-09-06","09:09:00",""
"7128651","16.5124","0.0004","20.7448","0.0006","14.1639","0.0005","90","","90","","90","","4851.8","0.3","120","2","120","2","","","","","","","","4","F m m m","-F 2 2","69","","","","- C9 N O17 Th3 -","- C9 N O17 Th3 -","- C72 N8 O136 Th24 -","8","0.25","","Zheng, Zhaofa; Lu, Huangjie; Guo, Xiaofeng; Zhou, Zhengyang; Wang, Yumin; Li, Zi-Jian; Xiao, Guo-Ping; Qian, Yuan; Lin, Jian; Wang, Jian-Qiang","Emergence of a thorium-organic framework as a radiation attenuator for selective X-ray dosimetry.","Chemical communications (Cambridge, England)","2021","57","66","8131","8134","10.1039/d1cc02649f","","","0.71073","MoKα","","0.0308","0.0269","","","0.0638","0.0654","","","","","","1.067","","","","has coordinates,has disorder","268550","2021-09-06","09:14:00",""
"7128652","16.5096","0.0003","20.7464","0.0004","14.1607","0.0003","90","","90","","90","","4850.25","0.16","120","2","120","2","","","","","","","","4","F m m m","-F 2 2","69","","","","- C9 N O17 Th3 -","- C9 N O17 Th3 -","- C72 N8 O136 Th24 -","8","0.25","","Zheng, Zhaofa; Lu, Huangjie; Guo, Xiaofeng; Zhou, Zhengyang; Wang, Yumin; Li, Zi-Jian; Xiao, Guo-Ping; Qian, Yuan; Lin, Jian; Wang, Jian-Qiang","Emergence of a thorium-organic framework as a radiation attenuator for selective X-ray dosimetry.","Chemical communications (Cambridge, England)","2021","57","66","8131","8134","10.1039/d1cc02649f","","","0.71073","MoKα","","0.03","0.028","","","0.0803","0.0817","","","","","","1.17","","","","has coordinates,has disorder","268550","2021-09-06","09:14:00",""
"7128653","10.539","0.002","11.834","0.002","10.092","0.002","90","","114.682","0.006","90","","1143.7","0.4","120","2","119.69","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 N3 O2 -","- C12 H13 N3 O2 -","- C48 H52 N12 O8 -","4","1","","Chakraborti, Gargi; Mandal, Tirtha; Roy, Charles Patriot; Dash, Jyotirmayee","A [3+2] cycloaddition-1,2-acyl migration-hydrolysis cascade for regioselective synthesis of 1,2,3-triazoles in water.","Chemical communications (Cambridge, England)","2021","57","64","7970","7973","10.1039/d1cc02801d","","","0.71073","MoKα","","0.0847","0.0544","","","0.1117","0.1233","","","","","","1.026","","","","has coordinates","268535","2021-09-06","09:10:14",""
"7128654","16.9923","0.0016","5.718","0.0004","7.2858","0.0007","90","","94.649","0.003","90","","705.57","0.11","110","2","110.2","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 N3 -","- C8 H7 N3 -","- C32 H28 N12 -","4","1","","Chakraborti, Gargi; Mandal, Tirtha; Roy, Charles Patriot; Dash, Jyotirmayee","A [3+2] cycloaddition-1,2-acyl migration-hydrolysis cascade for regioselective synthesis of 1,2,3-triazoles in water.","Chemical communications (Cambridge, England)","2021","57","64","7970","7973","10.1039/d1cc02801d","","","0.71073","MoKα","","0.056","0.0512","","","0.1349","0.1418","","","","","","1.046","","","","has coordinates","268535","2021-09-06","09:10:14",""
"7128655","6.91","0.0014","16.06","0.003","12.25","0.003","90","","91.67","0.03","90","","1358.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 O2 Si -","- C14 H18 O2 Si -","- C56 H72 O8 Si4 -","4","1","","Priebbenow, Daniel L.; Hua, Carol","Acyl silane directed Cp*Rh(III)-catalysed alkylation/annulation reactions.","Chemical communications (Cambridge, England)","2021","57","64","7938","7941","10.1039/d1cc03051e","","","0.71073","MoKα","","0.155","0.1174","","","0.3122","0.3947","","","","","","1.603","","","","has coordinates","268537","2021-09-06","09:10:33",""
"7128656","16.14","0.003","7.02","0.0014","12.55","0.003","90","","90","","90","","1422","0.5","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C15 H20 O2 Si -","- C15 H20 O2 Si -","- C60 H80 O8 Si4 -","4","0.5","","Priebbenow, Daniel L.; Hua, Carol","Acyl silane directed Cp*Rh(III)-catalysed alkylation/annulation reactions.","Chemical communications (Cambridge, England)","2021","57","64","7938","7941","10.1039/d1cc03051e","","","0.71073","MoKα","","0.0585","0.0464","","","0.148","0.2006","","","","","","1.091","","","","has coordinates,has disorder","268537","2021-09-06","09:10:34",""
"7128657","6.747","0.002","9.863","0.003","25.692","0.007","90","","95.475","0.009","90","","1701.9","0.9","297","","297","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H23 N O -","- C21 H23 N O -","- C84 H92 N4 O4 -","4","1","","Wu, Shi-Ping; Wang, Dong-Kai; Kang, Qing-Qing; Ge, Guo-Ping; Zheng, Hongxing; Zhu, Meiling; Li, Ting; Zhang, Jun-Qi; Wei, Wen-Ting","Sulfonyl radical triggered selective iodosulfonylation and bicyclization of 1,6-dienes.","Chemical communications (Cambridge, England)","2021","57","67","8288","8291","10.1039/d1cc03252f","","","0.71073","MoKα","","0.0573","0.047","","","0.1323","0.1424","","","","","","1.027","","","","has coordinates","268606","2021-09-06","09:38:52",""
"7128658","5.8434","0.0002","9.9102","0.0003","17.9362","0.0005","82.413","0.001","86.455","0.001","89.466","0.001","1027.61","0.06","170","2","170","","","","","","","","","4","P 1","P 1","1","","","","- C23 H25 N O4 -","- C23 H25 N O4 -","- C46 H50 N2 O8 -","2","2","","Hu, Yimin; Yan, Zhengyang; Shi, Wangyu; Liao, Jianning; Liu, Min; Pan, Ting; Wang, Wei; Wu, Yongjun; Hao, Xianghong; Guo, Hongchao","Copper/Lewis base cooperatively catalyzed asymmetric allylic alkylation of Morita-Baylis-Hillman carbonates with azomethine ylides.","Chemical communications (Cambridge, England)","2021","57","65","8059","8062","10.1039/d1cc02861h","","","1.54178","CuKα","","0.0281","0.0271","","","0.0667","0.0674","","","","","","1.049","","","","has coordinates","268570","2021-09-06","09:30:18",""
"7128659","7.3289","0.0006","17.1125","0.0016","28.191","0.002","90","","90","","90","","3535.6","0.5","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H14 Cl F2 N O2 -","- C20 H14 Cl F2 N O2 -","- C160 H112 Cl8 F16 N8 O16 -","8","1","","Wang, Shi-Chao; Liu, Peng-Yu; Chen, Yi-Xin; Shen, Zheng-Jia; Hao, Wen-Juan; Tu, Shu-Jiang; Jiang, Bo","Copper/silver <i>co</i>-mediated three-component bicyclization for accessing indeno[1,2-<i>c</i>]azepine-3,6-diones.","Chemical communications (Cambridge, England)","2021","57","64","7966","7969","10.1039/d1cc02973h","","","0.71073","MoKα","","0.1179","0.0654","","","0.1465","0.1649","","","","","","1.075","","","","has coordinates","268530","2021-09-06","09:09:20",""
"7128660","10.223","0.002","13.603","0.003","15.047","0.003","104","0.007","97.928","0.006","90.021","0.007","2009.7","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","4',4'-dimethyl-5'-phenyl-4,5-bis(trifluoromethyl)-4',5'-dihydro-2?5-spiro[[1,3,2]dioxaphosphole-2,2'-[2,5]epoxybenzo[d][1,3,6,2]trioxaphosphocine]","","","- C20 H15 F6 O6 P -","- C20 H15 F6 O6 P -","- C80 H60 F24 O24 P4 -","4","2","","Mironov, Vladimir F.; Dimukhametov, Mudaris N.; Ivkova, Gulnara A.; Khayarov, Khasan R.; Islamov, Daut R.; Litvinov, Igor A.","The formation of cage phosphoranes and their rearrangements in the reactions of substituted 2-(3-oxo-3-phenyl)ethoxybenzo[d]-1,3,2-dioxaphospholes with perfluorodiacetyl.","Chemical communications (Cambridge, England)","2021","57","68","8516","8519","10.1039/d1cc02941j","","","0.71073","MoKα","","0.1185","0.0613","","","0.1391","0.1653","","","","","","1.036","","","","has coordinates","268564","2021-09-06","09:29:23",""
"7128661","10.1241","0.0001","13.5556","0.0002","34.2865","0.0004","90","","98.111","0.001","90","","4658.35","0.1","99.99","0.13","99.99","0.13","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C23 H19 F6 O6 P -","- C23 H19 F6 O6 P -","- C184 H152 F48 O48 P8 -","8","1","","Mironov, Vladimir F.; Dimukhametov, Mudaris N.; Ivkova, Gulnara A.; Khayarov, Khasan R.; Islamov, Daut R.; Litvinov, Igor A.","The formation of cage phosphoranes and their rearrangements in the reactions of substituted 2-(3-oxo-3-phenyl)ethoxybenzo[d]-1,3,2-dioxaphospholes with perfluorodiacetyl.","Chemical communications (Cambridge, England)","2021","57","68","8516","8519","10.1039/d1cc02941j","","x-ray","1.54184","CuKα","","0.0377","0.035","","","0.091","0.0928","","","","","","1.056","","","","has coordinates","268564","2021-09-06","09:29:23",""
"7128662","11.4145","0.0005","17.9367","0.0008","8.0609","0.0003","90","","108.893","0.002","90","","1561.46","0.12","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H13 Br N4 -","- C20 H13 Br N4 -","- C80 H52 Br4 N16 -","4","1","","Miao, Fang; Chen, Hanjiao; Moles Quintero, Sergio; Xue, Guodong; Casado, Juan; Zheng, Yonghao","A nitrogen-doped asymmetric phenalenyl with a zwitterionic ground state.","Chemical communications (Cambridge, England)","2021","57","68","8433","8436","10.1039/d1cc02890a","","x-ray","1.54178","CuKα","","0.0283","0.0273","","","0.0771","0.078","","","","","","1.038","","","","has coordinates","268557","2021-09-06","09:17:04",""
"7128663","9.5314","0.0003","16.2298","0.0005","16.303","0.0005","91.074","0.002","103.031","0.002","93.835","0.002","2450.02","0.13","150","0.1","150","0.1","","","","","","","","10","P -1","-P 1","2","","","","- C47 H49 B Br Cl3 N7 O2 P Pt W -","- C47 H49 B Br Cl3 N7 O2 P Pt W -","- C94 H98 B2 Br2 Cl6 N14 O4 P2 Pt2 W2 -","2","1","","Burt, Liam K.; Hill, Anthony F.","Construction of an iminoketenylidene.","Chemical communications (Cambridge, England)","2021","57","68","8480","8483","10.1039/d1cc03310g","","x-ray","1.54184","CuKα","","0.0391","0.0329","","","0.0836","0.0876","","","","","","1.047","","","","has coordinates","268559","2021-09-06","09:18:37",""
"7128664","20.9197","0.0003","13.80583","0.00017","34.4091","0.0006","90","","90.7607","0.0014","90","","9936.9","0.3","150.01","0.1","150.01","0.1","","","","","","","","9","I 1 2/a 1","-I 2ya","15","","","","- C41 H46 B Br Cl3 N8 O2 Pt W -","- C38 H45 B Br N8 O2 Pt W -","- C304 H360 B8 Br8 N64 O16 Pt8 W8 -","8","1","","Burt, Liam K.; Hill, Anthony F.","Construction of an iminoketenylidene.","Chemical communications (Cambridge, England)","2021","57","68","8480","8483","10.1039/d1cc03310g","","x-ray","1.54184","CuKα","","0.0427","0.0341","","","0.0802","0.0865","","","","","","1.04","","","","has coordinates","268559","2021-09-06","09:18:47",""
"7128665","20.9875","0.0003","15.7357","0.0002","26.1799","0.0005","90","","105.436","0.002","90","","8334.1","0.2","150.01","0.1","150.01","0.1","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C89 H83 B2 Cl6 N7 O2 P2 Pt W -","- C89 H83 B2 Cl6 N7 O2 P2 Pt W -","- C356 H332 B8 Cl24 N28 O8 P8 Pt4 W4 -","4","1","","Burt, Liam K.; Hill, Anthony F.","Construction of an iminoketenylidene.","Chemical communications (Cambridge, England)","2021","57","68","8480","8483","10.1039/d1cc03310g","","x-ray","1.54184","CuKα","","0.0686","0.0471","","","0.1152","0.1277","","","","","","1.044","","","","has coordinates","268559","2021-09-06","09:18:50",""
"7128666","11.8143","0.0003","14.7029","0.0004","22.6429","0.0008","100.17","0.003","103.965","0.003","107.433","0.002","3507.6","0.2","150","0.1","150","0.1","","","","","","","","10","P -1","-P 1","2","","","","- C64 H62 B Cl3 F6 N7 O2 P3 Pt W -","- C64 H62 B Cl3 F6 N7 O2 P3 Pt W -","- C128 H124 B2 Cl6 F12 N14 O4 P6 Pt2 W2 -","2","1","","Burt, Liam K.; Hill, Anthony F.","Construction of an iminoketenylidene.","Chemical communications (Cambridge, England)","2021","57","68","8480","8483","10.1039/d1cc03310g","","x-ray","0.71073","MoKα","","0.0644","0.0442","","","0.0944","0.1033","","","","","","1.052","","","","has coordinates,has disorder","268559","2021-09-06","09:19:03",""
"7128667","9.4191","0.0002","15.8501","0.0004","16.1962","0.0004","88.182","0.002","77.516","0.002","82.34","0.002","2339.74","0.1","150.01","0.1","150.01","0.1","","","","","","","","10","P -1","-P 1","2","","","","- C46 H48 B Br Cl2 N7 O2 P Pt W -","- C46 H48 B Br Cl2 N7 O2 P Pt W -","- C92 H96 B2 Br2 Cl4 N14 O4 P2 Pt2 W2 -","2","1","","Burt, Liam K.; Hill, Anthony F.","Construction of an iminoketenylidene.","Chemical communications (Cambridge, England)","2021","57","68","8480","8483","10.1039/d1cc03310g","","x-ray","1.54184","CuKα","","0.049","0.0417","","","0.1045","0.1116","","","","","","1.017","","","","has coordinates","268559","2021-09-06","09:19:05",""
"7128668","8.4175","0.0002","12.4824","0.0002","10.4064","0.0002","90","","113.774","0.0009","90","","1000.62","0.04","170","2","170.03","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H21 B10 I -","- C16 H21 B10 I -","- C32 H42 B20 I2 -","2","1","","Ge, Yixiu; Qiu, Zaozao; Xie, Zuowei","Pd-catalyzed selective tetrafunctionalization of diiodo-<i>o</i>-carboranes.","Chemical communications (Cambridge, England)","2021","57","65","8071","8074","10.1039/d1cc03449a","","","1.34139","GaKα","","0.0239","0.0229","","","0.0544","0.055","","","","","","1.092","","","","has coordinates","268571","2021-09-06","09:30:33",""
"7128669","12.1538","0.0002","18.859","0.0003","17.6061","0.0003","90","","99.467","0.001","90","","3980.51","0.11","170","2","169.99","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C42 H52 B10 -","- C42 H52 B10 -","- C168 H208 B40 -","4","1","","Ge, Yixiu; Qiu, Zaozao; Xie, Zuowei","Pd-catalyzed selective tetrafunctionalization of diiodo-<i>o</i>-carboranes.","Chemical communications (Cambridge, England)","2021","57","65","8071","8074","10.1039/d1cc03449a","","","1.34139","GaKα","","0.0717","0.0538","","","0.1641","0.1798","","","","","","1.282","","","","has coordinates,has disorder","268571","2021-09-06","09:30:34",""
"7128670","24.0553","0.0004","10.9373","0.0002","17.0806","0.0003","90","","133.676","0.001","90","","3250.25","0.11","170","2","170","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H30 B10 I2 -","- C30 H30 B10 I2 -","- C120 H120 B40 I8 -","4","0.5","","Ge, Yixiu; Qiu, Zaozao; Xie, Zuowei","Pd-catalyzed selective tetrafunctionalization of diiodo-<i>o</i>-carboranes.","Chemical communications (Cambridge, England)","2021","57","65","8071","8074","10.1039/d1cc03449a","","","1.34139","GaKα","","0.0495","0.0412","","","0.1046","0.1111","","","","","","1.074","","","","has coordinates","268571","2021-09-06","09:30:34",""
"7128671","11.4458","0.0002","12.7974","0.0002","14.4835","0.0003","90","","99.139","0.001","90","","2094.56","0.07","170","2","170.02","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H21 B10 I -","- C16 H21 B10 I -","- C64 H84 B40 I4 -","4","1","","Ge, Yixiu; Qiu, Zaozao; Xie, Zuowei","Pd-catalyzed selective tetrafunctionalization of diiodo-<i>o</i>-carboranes.","Chemical communications (Cambridge, England)","2021","57","65","8071","8074","10.1039/d1cc03449a","","","1.34139","GaKα","","0.0332","0.032","","","0.0777","0.0787","","","","","","1.065","","","","has coordinates","268571","2021-09-06","09:30:34",""
"7128672","17.3533","0.0019","10.5696","0.0012","19.807","0.003","90","","97.064","0.009","90","","3605.4","0.8","170","2","169.98","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C42 H40 B10 -","- C42 H40 B10 -","- C168 H160 B40 -","4","0.5","","Ge, Yixiu; Qiu, Zaozao; Xie, Zuowei","Pd-catalyzed selective tetrafunctionalization of diiodo-<i>o</i>-carboranes.","Chemical communications (Cambridge, England)","2021","57","65","8071","8074","10.1039/d1cc03449a","","","1.34139","GaKα","","0.1518","0.1009","","","0.2362","0.2748","","","","","","1.055","","","","has coordinates","268571","2021-09-06","09:30:34",""
"7128673","19.5313","0.0003","21.5989","0.0003","17.6102","0.0003","90","","116.151","0.001","90","","6668.48","0.19","170","2","170.04","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 B10 -","- C36 H40 B10 -","- C288 H320 B80 -","8","2","","Ge, Yixiu; Qiu, Zaozao; Xie, Zuowei","Pd-catalyzed selective tetrafunctionalization of diiodo-<i>o</i>-carboranes.","Chemical communications (Cambridge, England)","2021","57","65","8071","8074","10.1039/d1cc03449a","","","1.34139","GaKα","","0.0876","0.0595","","","0.1372","0.1561","","","","","","1.026","","","","has coordinates","268571","2021-09-06","09:30:34",""
"7128674","8.4668","0.0001","12.0291","0.0001","18.2481","0.0002","90","","90","","90","","1858.53","0.03","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H15 Br N2 O2 -","- C23 H15 Br N2 O2 -","- C92 H60 Br4 N8 O8 -","4","1","","Sun, Lincong; Liu, Bingxian; Zhao, Yanlian; Chang, Junbiao; Kong, Lingheng; Wang, Fen; Deng, Wei-Qiao; Li, Xingwei","Rhodium(iii)-catalyzed asymmetric [4+1] spiroannulations of O-pivaloyl oximes with α-diazo compounds.","Chemical communications (Cambridge, England)","2021","57","67","8268","8271","10.1039/d1cc02888j","","x-ray","1.54184","CuKα","","0.0277","0.0271","","","0.0731","0.0736","","","","","","1.076","","","","has coordinates","268604","2021-09-06","09:38:38",""
"7128675","8.5174","0.0004","10.7513","0.0005","10.7978","0.0006","90.516","0.004","103.384","0.004","98.725","0.004","949.8","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H20 N2 O2 -","- C23 H20 N2 O2 -","- C46 H40 N4 O4 -","2","1","","Sun, Lincong; Liu, Bingxian; Zhao, Yanlian; Chang, Junbiao; Kong, Lingheng; Wang, Fen; Deng, Wei-Qiao; Li, Xingwei","Rhodium(iii)-catalyzed asymmetric [4+1] spiroannulations of O-pivaloyl oximes with α-diazo compounds.","Chemical communications (Cambridge, England)","2021","57","67","8268","8271","10.1039/d1cc02888j","","x-ray","1.54184","CuKα","","0.0646","0.0561","","","0.1589","0.1664","","","","","","1.042","","","","has coordinates","268604","2021-09-06","09:38:39",""
"7128676","7.461","0.0005","10.276","0.0005","11.7263","0.0008","70.212","0.005","73.352","0.006","70.063","0.005","780.25","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H15 N O3 -","- C18 H16 N O3 -","- C36 H32 N2 O6 -","2","1","","Sun, Lincong; Liu, Bingxian; Zhao, Yanlian; Chang, Junbiao; Kong, Lingheng; Wang, Fen; Deng, Wei-Qiao; Li, Xingwei","Rhodium(iii)-catalyzed asymmetric [4+1] spiroannulations of O-pivaloyl oximes with α-diazo compounds.","Chemical communications (Cambridge, England)","2021","57","67","8268","8271","10.1039/d1cc02888j","","x-ray","1.54184","CuKα","","0.0619","0.0552","","","0.1509","0.1588","","","","","","1.045","","","","has coordinates","268604","2021-09-06","09:38:39",""
"7128677","16.141","0.004","24.753","0.006","25.146","0.007","77.616","0.007","75.227","0.007","86.972","0.016","9489","4","100","","100","","","","","","","","","7","P -1","-P 1","2","DyL2","","","- C123 H184 Dy F9 O41 P8 S3 -","- C122 H184 Dy F6 O38 P8 S2 -","- C244 H368 Dy2 F12 O76 P16 S4 -","2","1","","Hosseinzadeh, Marjan; Sanz, Sergio; van Leusen, Jan; Izarova, Natalya V.; Brechin, Euan K.; Dalgarno, Scott J.; Kögerler, Paul","Phosphorylated-calix[4]arene double-deckers of single rare earth metal ions.","Chemical communications (Cambridge, England)","2021","57","65","8087","8090","10.1039/d1cc02910j","","","1.54178","CuKα","","0.1103","0.0844","","","0.2372","0.2608","","","","","","1.035","","","","has coordinates,has disorder","268573","2021-09-06","09:31:08",""
"7128678","17.915","0.003","20.056","0.004","22.245","0.004","90","","90","","90","","7993","3","173","2","173","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C46 H23 B F15 O P -","- C46 H23 B F15 O P -","- C368 H184 B8 F120 O8 P8 -","8","1","","Torres, Lucas C.; Dobrovetsky, Roman; Caputo, Christopher B.","Allenic phosphonium borate zwitterions via a phosphonium allenylidene intermediate.","Chemical communications (Cambridge, England)","2021","57","67","8272","8275","10.1039/d1cc03249f","","","0.71073","MoKα","","0.0585","0.0416","","","0.107","0.1229","","","","","","1.08","","","","has coordinates","268603","2021-09-06","09:38:31",""
"7128679","6.157","0.0009","10.7695","0.0015","17.131","0.002","79.693","0.005","81.084","0.005","88.594","0.005","1104.1","0.3","173","2","173","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H23 O P -","- C28 H23 O P -","- C56 H46 O2 P2 -","2","1","","Torres, Lucas C.; Dobrovetsky, Roman; Caputo, Christopher B.","Allenic phosphonium borate zwitterions via a phosphonium allenylidene intermediate.","Chemical communications (Cambridge, England)","2021","57","67","8272","8275","10.1039/d1cc03249f","","","0.71073","MoKα","","0.0782","0.071","","","0.176","0.1814","","","","","","1.087","","","","has coordinates","268603","2021-09-06","09:38:31",""
"7128680","18.5329","0.0002","17.6088","0.0002","9.477","0.00011","90","","102.175","0.0012","90","","3023.18","0.06","150.01","0.1","150.01","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H13 F3 O -","- C20 H13 F3 O -","- C160 H104 F24 O8 -","8","1","","Sanz-Vidal, Alvaro; Gaviña, Daniel; Sotorríos, Lia; Gómez-Bengoa, Enrique; López Ortiz, Fernando; Sánchez-Roselló, María; Del Pozo, Carlos","Unexpected metal-free synthesis of trifluoromethyl arenes <i>via</i> tandem coupling of dicyanoalkenes and conjugated fluorinated sulfinyl imines.","Chemical communications (Cambridge, England)","2021","57","65","8023","8026","10.1039/d1cc03161a","","x-ray","1.54184","CuKα","","0.0431","0.0401","","","0.111","0.1137","","","","","","1.05","","","","has coordinates,has disorder","268567","2021-09-06","09:29:55",""
"7128681","8.7235","0.0004","9.8806","0.0003","10.7952","0.0004","99.278","0.003","94.538","0.003","113.082","0.003","834.34","0.06","150.01","0.1","150.01","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C22 H17 F3 O -","- C22 H17 F3 O -","- C44 H34 F6 O2 -","2","1","","Sanz-Vidal, Alvaro; Gaviña, Daniel; Sotorríos, Lia; Gómez-Bengoa, Enrique; López Ortiz, Fernando; Sánchez-Roselló, María; Del Pozo, Carlos","Unexpected metal-free synthesis of trifluoromethyl arenes <i>via</i> tandem coupling of dicyanoalkenes and conjugated fluorinated sulfinyl imines.","Chemical communications (Cambridge, England)","2021","57","65","8023","8026","10.1039/d1cc03161a","","x-ray","1.54184","CuKα","","0.036","0.034","","","0.0865","0.0875","","","","","","1.078","","","","has coordinates","268567","2021-09-06","09:29:55",""
"7128682","17.3827","0.0003","22.9977","0.0004","38.292","0.0006","90","","90","","90","","15307.7","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C141 H204 O21 P3 Tb3 -","- C141 H204 O21 P3 Tb3 -","- C564 H816 O84 P12 Tb12 -","4","1","","Kitagawa, Yuichi; Matsuda, Kenji; da Rosa, Pedro Paulo Ferreira; Fushimi, Koji; Hasegawa, Yasuchika","Long-lived emission beyond 1000 nm: control of excited-state dynamics in a dinuclear Tb(III)-Nd(III) complex.","Chemical communications (Cambridge, England)","2021","57","65","8047","8050","10.1039/d1cc03596g","","x-ray","0.71073","MoKα","","0.0521","0.0398","","","0.0918","0.0949","","","","","","1.051","","","","has coordinates","268572","2021-09-06","09:30:54",""
"7128683","13.4524","0.0005","16.5651","0.0006","22.9953","0.0009","88.5491","0.0013","75.5823","0.0011","87.8446","0.0011","4958.7","0.3","123","2","123.15","","","","","","","","","5","P -1","-P 1","2","","","","- C98 H138 O14 P2 Tb2 -","- C96 H138 O14 P2 Tb2 -","- C192 H276 O28 P4 Tb4 -","2","1","","Kitagawa, Yuichi; Matsuda, Kenji; da Rosa, Pedro Paulo Ferreira; Fushimi, Koji; Hasegawa, Yasuchika","Long-lived emission beyond 1000 nm: control of excited-state dynamics in a dinuclear Tb(III)-Nd(III) complex.","Chemical communications (Cambridge, England)","2021","57","65","8047","8050","10.1039/d1cc03596g","","","0.71075","MoKα","","0.089","0.07","","","0.1601","0.1693","","","","","","1.242","","","","has coordinates,has disorder","268572","2021-09-06","09:30:54",""
"7128684","5.4939","0.0006","9.5425","0.0011","29.273","0.004","82.514","0.006","87.742","0.006","84.22","0.006","1513.3","0.3","123","","123","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H47 N5 O4 S -","- C28 H47 N5 O4 S -","- C56 H94 N10 O8 S2 -","2","1","","O'Neil, Alex T; Harrison, John A.; Kitchen, Jonathan A.","Ultra-thin films of amphiphilic lanthanide complexes: multi-colour emission from molecular monolayers.","Chemical communications (Cambridge, England)","2021","57","65","8067","8070","10.1039/d1cc02628c","","","1.54178","CuKα","","0.0549","0.0496","","","0.1233","0.1277","","","","","","1.067","","","","has coordinates","268568","2021-09-06","09:30:03",""
"7128685","12.8055","0.0002","15.3364","0.0002","22.2271","0.0003","90","","103.073","0.001","90","","4252.05","0.11","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H32 B2 N2 O4 -","- C32 H32 B2 N2 O4 -","- C192 H192 B12 N12 O24 -","6","1.5","","Verma, Piyush Kumar; Meher, Naresh Kumar; Geetharani, K.","Homolytic cleavage of diboron(4) compounds using diazabutadiene derivatives.","Chemical communications (Cambridge, England)","2021","57","64","7886","7889","10.1039/d1cc02881b","","","0.71073","MoKα","","0.0795","0.0478","","","0.1131","0.1325","","","","","","1.02","","","","has coordinates","268531","2021-09-06","09:09:34",""
"7128686","22.8528","0.0009","13.7386","0.0005","12.6423","0.0005","90","","118.405","0.002","90","","3491.4","0.2","296","","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H42 B2 N2 O4 -","- C38 H44 B2 N2 O4 -","- C152 H176 B8 N8 O16 -","4","0.5","","Verma, Piyush Kumar; Meher, Naresh Kumar; Geetharani, K.","Homolytic cleavage of diboron(4) compounds using diazabutadiene derivatives.","Chemical communications (Cambridge, England)","2021","57","64","7886","7889","10.1039/d1cc02881b","","","0.71073","MoKα","","0.0971","0.0719","","","0.1781","0.2106","","","","","","0.935","","","","has coordinates","268531","2021-09-06","09:09:34",""
"7128687","8.824","0.0002","10.816","0.0003","11.5045","0.0003","110.59","0.001","93.642","0.001","105.924","0.001","972.67","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H28 N3 O2 -","- C21 H24 N O3 -","- C42 H48 N2 O6 -","2","1","","Verma, Piyush Kumar; Meher, Naresh Kumar; Geetharani, K.","Homolytic cleavage of diboron(4) compounds using diazabutadiene derivatives.","Chemical communications (Cambridge, England)","2021","57","64","7886","7889","10.1039/d1cc02881b","","","0.71073","MoKα","","0.0967","0.0667","","","0.2051","0.2373","","","","","","1.027","","","","has coordinates","268531","2021-09-06","09:09:34",""
"7128688","5.3254","0.001","8.7035","0.0016","11.343","0.002","92.747","0.01","102.575","0.01","107.729","0.01","485.06","0.16","296","2","296","2","","","","","","","","7","P -1","-P 1","2","SZ-7","","","- C12 H2 F2 N2 O6 P2 Zr -","- C12 H4 F2 N2 O6 P2 Zr -","- C12 H4 F2 N2 O6 P2 Zr -","1","0.5","","Zhang, Jiarong; Chen, Long; Dai, Xing; Chen, Lixi; Zhai, Fuwan; Yu, Weifeng; Guo, Shikai; Yang, Lijiang; Chen, Lanhua; Zhang, Yugang; He, Linwei; Chen, Changlun; Chai, Zhifang; Wang, Shuao","Efficient Sr-90 removal from highly alkaline solution by an ultrastable crystalline zirconium phosphonate.","Chemical communications (Cambridge, England)","2021","57","68","8452","8455","10.1039/d1cc02446a","","","0.71073","MoKα","","0.1314","0.0995","","","0.275","0.2953","","","","","","1.078","","","","has coordinates","268561","2021-09-06","09:23:55",""
"7128689","12.2864","0.0007","12.6134","0.0007","17.4682","0.001","76.476","0.003","89.608","0.004","89.864","0.003","2632","0.3","170","","170","","","","","","","","","4","P -1","-P 1","2","","","","- C120.67 H95.33 Cl13.83 N4 -","- C120.667 H95.3332 Cl13.8332 N4 -","- C120.667 H95.3332 Cl13.8332 N4 -","1","0.5","","Baggi, Giorgio; Wilson, Benjamin H.; Dhara, Ayan; O'Keefe, Christopher A; Schurko, Robert W.; Loeb, Stephen J.","Dynamics of a [2]rotaxane wheel in a crystalline molecular solid.","Chemical communications (Cambridge, England)","2021","57","66","8210","8213","10.1039/d1cc03009d","","","1.54178","CuKα","","0.1573","0.1323","","","0.3131","0.3326","","","","","","1.041","","","","has coordinates,has disorder","268552","2021-09-06","09:14:34",""
"7128690","9.0214","0.0009","13.7471","0.0013","22.9679","0.0019","94.14","0.007","93.355","0.008","100.854","0.008","2782.6","0.5","170","","170","","","","","","","","","4","P -1","-P 1","2","","","","- C132 H118 N4 O6 -","- C132 H118 N4 O6 -","- C132 H118 N4 O6 -","1","0.5","","Baggi, Giorgio; Wilson, Benjamin H.; Dhara, Ayan; O'Keefe, Christopher A; Schurko, Robert W.; Loeb, Stephen J.","Dynamics of a [2]rotaxane wheel in a crystalline molecular solid.","Chemical communications (Cambridge, England)","2021","57","66","8210","8213","10.1039/d1cc03009d","","x-ray","1.54184","CuKα","","0.1798","0.0817","","","0.1925","0.2472","","","","","","0.901","","","","has coordinates,has disorder","268552","2021-09-06","09:14:36",""
"7128691","10.36756","0.00012","11.59613","0.00014","17.36693","0.00019","90","","90","","90","","2087.91","0.04","291","2","291","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C22 H22 F2 N2 O3 S -","- C22 H22 F2 N2 O3 S -","- C88 H88 F8 N8 O12 S4 -","4","1","","Dai, Rui-Han; Han, Lu; Wang, Qi; Tian, Shi-Kai","Strain-release C-C bond cleavage enables the [2,3]-sigmatropic rearrangement of tertiary allylamines.","Chemical communications (Cambridge, England)","2021","57","68","8449","8451","10.1039/d1cc03141d","","x-ray","1.54184","CuKα","","0.0367","0.0361","","","0.0996","0.1003","","","","","","1.089","","","","has coordinates","268562","2021-09-06","09:26:33",""
"7128692","12.21316","0.00016","17.3615","0.0002","10.31999","0.00014","90","","98.3484","0.0013","90","","2165.05","0.05","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 F2 N2 O3 S -","- C22 H22 F2 N2 O3 S -","- C88 H88 F8 N8 O12 S4 -","4","1","","Dai, Rui-Han; Han, Lu; Wang, Qi; Tian, Shi-Kai","Strain-release C-C bond cleavage enables the [2,3]-sigmatropic rearrangement of tertiary allylamines.","Chemical communications (Cambridge, England)","2021","57","68","8449","8451","10.1039/d1cc03141d","","x-ray","1.54184","CuKα","","0.0515","0.0468","","","0.1295","0.1348","","","","","","1.03","","","","has coordinates","268562","2021-09-06","09:27:09",""
"7128693","14.0571","0.0005","17.3975","0.0006","13.7185","0.0005","90","","106.085","0.004","90","","3223.6","0.2","293.24","0.1","293.24","0.1","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C48 H32 Mn2 N4 O12 -","- C48 H32 Mn2 N4 O12 -","- C96 H64 Mn4 N8 O24 -","2","0.25","","Qin, Jian-Hua; Xu, Peng; Huang, Ya-Dan; Xiao, Lu-Yao; Lu, Weiwei; Yang, Xiao-Gang; Ma, Lu-Fang; Zang, Shuang-Quan","High loading of Mn(ii)-metalated porphyrin in a MOF for photocatalytic CO<sub>2</sub> reduction in gas-solid conditions.","Chemical communications (Cambridge, England)","2021","57","68","8468","8471","10.1039/d1cc02847b","","x-ray","0.71073","MoKα","","0.0559","0.0416","","","0.1227","0.1282","","","","","","1.106","","","","has coordinates","268560","2021-09-06","09:21:11",""
"7128694","6.2206","0.0006","18.2032","0.0013","18.9733","0.0015","90","","94.68","0.007","90","","2141.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H23 N O4 -","- C27 H23 N O4 -","- C108 H92 N4 O16 -","4","1","","Gong, Lingzhen; Zhao, He; Yang, Jian; Jiang, Huanfeng; Zhang, Min","Selective construction of fused heterocycles by an iridium-catalyzed reductive three-component annulation reaction.","Chemical communications (Cambridge, England)","2021","57","67","8292","8295","10.1039/d1cc03332h","","","0.71073","MoKα","","0.1267","0.0705","","","0.1265","0.1507","","","","","","1.022","","","","has coordinates","268605","2021-09-06","09:38:45",""
"7128695","34.119","0.008","6.9698","0.0017","23.025","0.006","90","","107.554","0.004","90","","5220","2","296.15","","296.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H36 B9 N O -","- C22 H36 B9 N O -","- C176 H288 B72 N8 O8 -","8","1","","Huang, Ronghui; Zhao, Weijia; Xu, Shengwen; Xu, Jingkai; Li, Chunxiao; Lu, Changsheng; Yan, Hong","Photoredox B-H functionalization to selective B-N(sp<sup>3</sup>) coupling of nido-carborane with primary and secondary amines.","Chemical communications (Cambridge, England)","2021","57","69","8580","8583","10.1039/d1cc03326c","","","0.71073","MoKα","","0.1053","0.0744","","","0.2067","0.236","","","","","","1.042","","","","has coordinates","268610","2021-09-06","09:43:53",""
"7128696","6.9564","0.0003","11.0803","0.0005","17.5164","0.0008","81.973","0.002","88.116","0.002","82.705","0.002","1325.94","0.1","296.15","","296.15","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H32 B9 Cl2 N -","- C23 H32 B9 Cl2 N -","- C46 H64 B18 Cl4 N2 -","2","1","","Huang, Ronghui; Zhao, Weijia; Xu, Shengwen; Xu, Jingkai; Li, Chunxiao; Lu, Changsheng; Yan, Hong","Photoredox B-H functionalization to selective B-N(sp<sup>3</sup>) coupling of nido-carborane with primary and secondary amines.","Chemical communications (Cambridge, England)","2021","57","69","8580","8583","10.1039/d1cc03326c","","","0.71073","MoKα","","0.0975","0.0677","","","0.1257","0.1387","","","","","","1.077","","","","has coordinates,has disorder","268610","2021-09-06","09:43:57",""
"7128697","39.638","0.012","6.973","0.002","16.345","0.005","90","","107.786","0.005","90","","4302","2","296.15","","296.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H28 B9 N O -","- C18 H28 B9 N O -","- C144 H224 B72 N8 O8 -","8","1","","Huang, Ronghui; Zhao, Weijia; Xu, Shengwen; Xu, Jingkai; Li, Chunxiao; Lu, Changsheng; Yan, Hong","Photoredox B-H functionalization to selective B-N(sp<sup>3</sup>) coupling of nido-carborane with primary and secondary amines.","Chemical communications (Cambridge, England)","2021","57","69","8580","8583","10.1039/d1cc03326c","","","0.71073","MoKα","","0.1039","0.0583","","","0.1456","0.1755","","","","","","1.023","","","","has coordinates","268610","2021-09-06","09:44:01",""
"7128698","15.736","0.0011","10.2256","0.0007","14.5955","0.0011","90","","117.508","0.003","90","","2083","0.3","173","2","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H31 Ge N -","- C24 H31 Ge N -","- C96 H124 Ge4 N4 -","4","1","","Yang, Shuo; Jiang, Wei-Tao; Xiao, Bin","Tertiary cyclopropyl carbagermatranes: synthesis and cross-coupling.","Chemical communications (Cambridge, England)","2021","57","66","8143","8146","10.1039/d1cc02930d","","","1.34139","GaKα","","0.0441","0.0411","","","0.1135","0.1175","","","","","","1.069","","","","has coordinates","268547","2021-09-06","09:13:20",""
"7128699","32.854","0.006","5.8699","0.0012","34.286","0.006","90","","90","","90","","6612","2","173","2","173","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C22 H20 O -","- C22 H20 O -","- C352 H320 O16 -","16","2","","Yang, Shuo; Jiang, Wei-Tao; Xiao, Bin","Tertiary cyclopropyl carbagermatranes: synthesis and cross-coupling.","Chemical communications (Cambridge, England)","2021","57","66","8143","8146","10.1039/d1cc02930d","","","1.34139","GaKα","","0.2265","0.1063","","","0.2407","0.3178","","","","","","0.977","","","","has coordinates","268547","2021-09-06","09:13:23",""
"7128700","13.0496","0.0002","13.9185","0.0002","20.5273","0.0003","94.291","0.001","106.075","0.001","116.436","0.001","3121.81","0.09","123.15","","123.15","","","","","","","","","6","P -1","-P 1","2","","","","- C64 H94 K N4 O9 V -","- C64 H94 K N4 O9 V -","- C128 H188 K2 N8 O18 V2 -","2","1","","Hasegawa, Sui; Ishida, Yutaka; Kawaguchi, Hiroyuki","Systematic reductive oligomerization of isocyanides with a vanadium(ii) complex.","Chemical communications (Cambridge, England)","2021","57","67","8296","8299","10.1039/d1cc03463d","","x-ray","1.54184","CuKα","","0.0419","0.0396","","","0.1065","0.1081","","","","","","1.041","","","","has coordinates","268607","2021-09-06","09:39:21",""
"7128701","28.8046","0.0005","28.1999","0.0006","29.2972","0.0005","90","","90","","90","","23797.7","0.8","123","","123","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C132.5 H166 K2 N4 O8 V2 -","- C122 H154 K2 N4 O8 V2 -","- C976 H1232 K16 N32 O64 V16 -","8","1","","Hasegawa, Sui; Ishida, Yutaka; Kawaguchi, Hiroyuki","Systematic reductive oligomerization of isocyanides with a vanadium(ii) complex.","Chemical communications (Cambridge, England)","2021","57","67","8296","8299","10.1039/d1cc03463d","","x-ray","0.71073","MoKα","","0.161","0.0882","","","0.1676","0.1966","","","","","","1.026","","","","has coordinates,has disorder","268607","2021-09-06","09:39:22",""
"7128702","13.4233","0.0003","16.9491","0.0004","19.8449","0.0004","67.448","0.002","81.026","0.002","69.914","0.002","3914.57","0.17","123","","123","","","","","","","","","6","P -1","-P 1","2","","","","- C86 H115 K N4 O5 V -","- C86 H115 K N4 O5 V -","- C172 H230 K2 N8 O10 V2 -","2","1","","Hasegawa, Sui; Ishida, Yutaka; Kawaguchi, Hiroyuki","Systematic reductive oligomerization of isocyanides with a vanadium(ii) complex.","Chemical communications (Cambridge, England)","2021","57","67","8296","8299","10.1039/d1cc03463d","","x-ray","0.71073","MoKα","","0.0817","0.0591","","","0.1559","0.1717","","","","","","1.03","","","","has coordinates,has disorder","268607","2021-09-06","09:39:22",""
"7128703","39.7195","0.0002","17.1396","0.0001","18.6902","0.0001","90","","93.079","0.001","90","","12705.5","0.12","123","","123","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C65 H94 K N5 O4 V -","- C65 H94 K N5 O4 V -","- C520 H752 K8 N40 O32 V8 -","8","1","","Hasegawa, Sui; Ishida, Yutaka; Kawaguchi, Hiroyuki","Systematic reductive oligomerization of isocyanides with a vanadium(ii) complex.","Chemical communications (Cambridge, England)","2021","57","67","8296","8299","10.1039/d1cc03463d","","x-ray","1.54184","CuKα","","0.039","0.0363","","","0.1006","0.1026","","","","","","1.066","","","","has coordinates,has disorder","268607","2021-09-06","09:39:22",""
"7128704","14.2203","0.0004","22.6239","0.0007","15.3959","0.0004","90","","96.58","0.002","90","","4920.5","0.2","123","","123","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H69 K N2 O4 Si V -","- C48 H69 K N2 O4 Si V -","- C192 H276 K4 N8 O16 Si4 V4 -","4","1","","Hasegawa, Sui; Ishida, Yutaka; Kawaguchi, Hiroyuki","Systematic reductive oligomerization of isocyanides with a vanadium(ii) complex.","Chemical communications (Cambridge, England)","2021","57","67","8296","8299","10.1039/d1cc03463d","","x-ray","0.71073","MoKα","","0.0661","0.0465","","","0.1014","0.1107","","","","","","1.027","","","","has coordinates,has disorder","268607","2021-09-06","09:39:22",""
"7128705","12.3804","0.0002","14.2439","0.0003","16.395","0.0003","73.837","0.002","70.96","0.002","68.344","0.002","2498.7","0.09","123.15","","123.15","","","","","","","","","5","P -1","-P 1","2","","","","- C57 H64 N3 O4 V -","- C57 H64 N3 O4 V -","- C114 H128 N6 O8 V2 -","2","1","","Hasegawa, Sui; Ishida, Yutaka; Kawaguchi, Hiroyuki","Systematic reductive oligomerization of isocyanides with a vanadium(ii) complex.","Chemical communications (Cambridge, England)","2021","57","67","8296","8299","10.1039/d1cc03463d","","x-ray","1.54184","CuKα","","0.0395","0.0361","","","0.0969","0.0992","","","","","","1.083","","","","has coordinates","268607","2021-09-06","09:39:22",""
"7128706","16.1228","0.0003","17.1683","0.0004","17.573","0.0006","96.746","0.002","116.027","0.002","94.642","0.002","4292.6","0.2","123","","123","","","","","","","","","6","P -1","-P 1","2","","","","- C94 H111 K2 N5 O8 V -","- C84 H96 K2 N5 O8 V -","- C168 H192 K4 N10 O16 V2 -","2","1","","Hasegawa, Sui; Ishida, Yutaka; Kawaguchi, Hiroyuki","Systematic reductive oligomerization of isocyanides with a vanadium(ii) complex.","Chemical communications (Cambridge, England)","2021","57","67","8296","8299","10.1039/d1cc03463d","","x-ray","1.54184","CuKα","","0.1055","0.0775","","","0.2142","0.2413","","","","","","0.986","","","","has coordinates","268607","2021-09-06","09:39:22",""
"7128707","16.6092","0.0006","17.7479","0.0006","22.6639","0.0007","78.203","0.003","88.731","0.003","83.903","0.003","6502.7","0.4","123","","123","","","","","","","","","6","P -1","-P 1","2","","","","- C135 H191 K2 N5 O14 V2 -","- C129 H177 K2 N5 O14 V2 -","- C258 H354 K4 N10 O28 V4 -","2","1","","Hasegawa, Sui; Ishida, Yutaka; Kawaguchi, Hiroyuki","Systematic reductive oligomerization of isocyanides with a vanadium(ii) complex.","Chemical communications (Cambridge, England)","2021","57","67","8296","8299","10.1039/d1cc03463d","","x-ray","0.71073","MoKα","","0.156","0.0797","","","0.179","0.2236","","","","","","0.976","","","","has coordinates","268607","2021-09-06","09:39:22",""
"7128708","25.2644","0.001","17.794","0.0008","15.8935","0.0007","90","","112.986","0.001","90","","6577.7","0.5","151","","151","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C60 H72 F12 N6 O15 P2 -","- C60 H72 F12 N6 O15 P2 -","- C240 H288 F48 N24 O60 P8 -","4","0.5","","Chang, Jin-Ping; Sun, Li-Ying; Zhang, Zi-En; An, Yuan-Yuan; Zhang, Le; Yu, Jian-Gang; Han, Ying-Feng","A metal-carbene template approach enables efficient synthesis of a functionalized cage-annulated crown ether.","Chemical communications (Cambridge, England)","2021","57","69","8584","8587","10.1039/d1cc03416b","","","0.71073","MoKα","","0.0779","0.0512","","","0.13","0.1476","","","","","","1.043","","","","has coordinates,has disorder","268615","2021-09-06","09:49:12",""
"7128709","9.601","0.002","12.221","0.003","13.822","0.003","71.295","0.008","77.227","0.008","82.243","0.008","1494.5","0.6","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H37 Bi F3 O4 P S -","- C25 H37 Bi F3 O4 P S -","- C50 H74 Bi2 F6 O8 P2 S2 -","2","1","","Sharma, Deepti; Balasubramaniam, Selvakumar; Kumar, Sandeep; Jemmis, Eluvathingal D.; Venugopal, Ajay","Reversing Lewis acidity from bismuth to antimony.","Chemical communications (Cambridge, England)","2021","57","71","8889","8892","10.1039/d1cc03038h","","","0.71073","MoKα","","0.0604","0.0371","","","0.0737","0.0827","","","","","","1.029","","","","has coordinates,has disorder","269653","2021-10-06","13:59:27",""
"7128710","10.277","0.004","15.806","0.006","19.121","0.007","90","","96.915","0.013","90","","3083","2","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H37 F3 O4 P S Sb -","- C25 H37 F3 O4 P S Sb -","- C100 H148 F12 O16 P4 S4 Sb4 -","4","1","","Sharma, Deepti; Balasubramaniam, Selvakumar; Kumar, Sandeep; Jemmis, Eluvathingal D.; Venugopal, Ajay","Reversing Lewis acidity from bismuth to antimony.","Chemical communications (Cambridge, England)","2021","57","71","8889","8892","10.1039/d1cc03038h","","","0.71073","MoKα","","0.1032","0.0551","","","0.1094","0.1316","","","","","","1.015","","","","has coordinates,has disorder","269653","2021-10-06","13:59:28",""
"7128711","7.2653","0.0019","16.097","0.004","17.027","0.005","85.443","0.008","89.167","0.009","84.022","0.008","1974.2","0.9","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H22 F3 O3 S Sb -","- C19 H22 F3 O3 S Sb -","- C76 H88 F12 O12 S4 Sb4 -","4","2","","Sharma, Deepti; Balasubramaniam, Selvakumar; Kumar, Sandeep; Jemmis, Eluvathingal D.; Venugopal, Ajay","Reversing Lewis acidity from bismuth to antimony.","Chemical communications (Cambridge, England)","2021","57","71","8889","8892","10.1039/d1cc03038h","","","0.71073","MoKα","","0.0844","0.0642","","","0.1384","0.1481","","","","","","1.112","","","","has coordinates,has disorder","269653","2021-10-06","13:59:28",""
"7128712","10.8544","0.0001","13.903","0.0002","16.2102","0.0002","86.3726","0.0007","72.2389","0.0008","86.3793","0.0007","2322.52","0.05","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H52 Cl4 N8 Ni4 O10 -","- C38 H52 Cl4 N8 Ni4 O10 -","- C76 H104 Cl8 N16 Ni8 O20 -","2","1","","García-Álvarez, Ana C; Gamboa-Ramírez, Stefani; Martínez-Otero, Diego; Orio, Maylis; Castillo, Ivan","Self-assembled nickel cubanes as oxygen evolution catalysts.","Chemical communications (Cambridge, England)","2021","57","69","8608","8611","10.1039/d1cc03227e","","","1.54178","CuKα","","0.0442","0.0341","","","0.0812","0.0866","","","","","","1.043","","","","has coordinates,has disorder","268611","2021-09-06","09:44:16",""
"7128713","15.1023","0.0006","15.5842","0.0006","17.1586","0.0007","93.357","0.003","108.671","0.002","94.518","0.003","3798.9","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H55.74 Cl26 N8 Ni4 O8.37 -","- C46.998 H55.738 Cl25.996 N8 Ni4 O8.37 -","- C93.996 H111.476 Cl51.992 N16 Ni8 O16.74 -","2","1","","García-Álvarez, Ana C; Gamboa-Ramírez, Stefani; Martínez-Otero, Diego; Orio, Maylis; Castillo, Ivan","Self-assembled nickel cubanes as oxygen evolution catalysts.","Chemical communications (Cambridge, England)","2021","57","69","8608","8611","10.1039/d1cc03227e","","","1.54178","CuKα","","0.1009","0.0846","","","0.2322","0.25","","","","","","1.047","","","","has coordinates,has disorder","268611","2021-09-06","09:44:17",""
"7128714","5.48306","0.00015","15.3486","0.0004","17.9094","0.0005","79.089","0.002","84.67","0.002","88.069","0.002","1473.36","0.07","113","","113","","","","","","","","","6","P -1","-P 1","2","BrPQ-1","4,4',4'',4'''-(5,10-dibromopyrazino[2,3-g]quinoxaline-2,3,7,8-tetrayl)tetrabenzoic acid","","- C62 H36.28 Br1.72 Cl8 N4 O8 -","- C38 H20.28 Br1.72 N4 O8 -","- C38 H20.28 Br1.72 N4 O8 -","1","0.5","","Kubo, Haruka; Oketani, Ryusei; Hisaki, Ichiro","Quasi single-crystalline transformation of porous frameworks accompanied by interlayer rearrangements of hydrogen bonds.","Chemical communications (Cambridge, England)","2021","57","69","8568","8571","10.1039/d1cc03287a","","","0.71073","MoKα","","0.0338","0.0305","","","0.0919","0.0933","","","","","","1.071","","","","has coordinates,has disorder","268608","2021-09-06","09:40:46",""
"7128715","5.584","0.002","12.305","0.003","15.827","0.005","103.84","0.02","93.62","0.03","91.13","0.03","1053.1","0.6","113","","113","","","","","","","","","5","P -1","-P 1","2","BrPQ-3a","4,4',4'',4'''-(5,10-dibromopyrazino[2,3-g]quinoxaline-2,3,7,8-tetrayl)tetrabenzoic acid","","- C38 H20.28 Br1.72 N4 O8 -","- C38 H20.28 Br1.72 N4 O8 -","- C38 H20.28 Br1.72 N4 O8 -","1","0.5","","Kubo, Haruka; Oketani, Ryusei; Hisaki, Ichiro","Quasi single-crystalline transformation of porous frameworks accompanied by interlayer rearrangements of hydrogen bonds.","Chemical communications (Cambridge, England)","2021","57","69","8568","8571","10.1039/d1cc03287a","","","0.71073","MoKα","","0.2465","0.1058","","","0.2453","0.3275","","","","","","0.915","","","","has coordinates,has disorder","268608","2021-09-06","09:40:46",""
"7128716","5.4836","0.0004","11.8374","0.0012","15.4284","0.0012","102.618","0.008","92.409","0.006","92.015","0.007","975.42","0.15","113","","113","","","","","","","","","5","P -1","-P 1","2","BrPQ-2a","4,4',4'',4'''-(5,10-dibromopyrazino[2,3-g]quinoxaline-2,3,7,8-tetrayl)tetrabenzoic acid","","- C38 H20.28 Br1.72 N4 O8 -","- C38 H20.28 Br1.72 N4 O8 -","- C38 H20.28 Br1.72 N4 O8 -","1","0.5","","Kubo, Haruka; Oketani, Ryusei; Hisaki, Ichiro","Quasi single-crystalline transformation of porous frameworks accompanied by interlayer rearrangements of hydrogen bonds.","Chemical communications (Cambridge, England)","2021","57","69","8568","8571","10.1039/d1cc03287a","","","0.71073","MoKα","","0.1991","0.0796","","","0.176","0.2222","","","","","","0.953","","","","has coordinates,has disorder","268608","2021-09-06","09:40:46",""
"7128717","5.5503","0.0002","11.9493","0.0005","15.1638","0.0005","102.503","0.003","91.72","0.003","92.766","0.003","979.86","0.06","113","","113","","","","","","","","","6","P -1","-P 1","2","BrPQ-2","4,4',4'',4'''-(5,10-dibromopyrazino[2,3-g]quinoxaline-2,3,7,8-tetrayl)tetrabenzoic acid","","- C44 H24.28 Br1.72 Cl2 N4 O8 -","- C44 H24.28 Br1.72 Cl2 N4 O8 -","- C44 H24.28 Br1.72 Cl2 N4 O8 -","1","0.5","","Kubo, Haruka; Oketani, Ryusei; Hisaki, Ichiro","Quasi single-crystalline transformation of porous frameworks accompanied by interlayer rearrangements of hydrogen bonds.","Chemical communications (Cambridge, England)","2021","57","69","8568","8571","10.1039/d1cc03287a","","","0.71073","MoKα","","0.0668","0.0542","","","0.1507","0.1606","","","","","","1.081","","","","has coordinates,has disorder","268608","2021-09-06","09:40:46",""
"7128718","18.9817","0.0006","18.9817","0.0006","28.8986","0.0015","90","","90","","120","","9017.3","0.6","175","","175","","","","","","","","","5","P -3 1 c","-P 3 2c","163","","","","- Cr2 Dy6 Na6 Nb30 O148 -","- Cr2 Dy6 Na6 Nb30 O141 -","- Cr4 Dy12 Na12 Nb60 O282 -","2","0.166667","","Lin, Yu-Diao; Ge, Rui; Tian, Chong-Bin; Sun, Cai; Sun, Yan-Qiong; Zeng, Qing-Xin; Li, Xin-Xiong; Zheng, Shou-Tian","3d-4f Heterometallic cluster incorporated polyoxoniobates with magnetic properties.","Chemical communications (Cambridge, England)","2021","57","69","8624","8627","10.1039/d1cc03262c","","","0.71073","MoKα","","0.0419","0.0343","","","0.1018","0.1078","","","","","","0.857","","","","has coordinates","268613","2021-09-06","09:46:20",""
"7128719","19.0042","0.0007","19.0042","0.0007","28.9507","0.0017","90","","90","","120","","9055","0.7","175","","175","","","","","","","","","5","P -3 1 c","-P 3 2c","163","","","","- Dy6 Mn2 Na6 Nb30 O148 -","- Dy6 Mn2 Na6 Nb30 O141 -","- Dy12 Mn4 Na12 Nb60 O282 -","2","0.166667","","Lin, Yu-Diao; Ge, Rui; Tian, Chong-Bin; Sun, Cai; Sun, Yan-Qiong; Zeng, Qing-Xin; Li, Xin-Xiong; Zheng, Shou-Tian","3d-4f Heterometallic cluster incorporated polyoxoniobates with magnetic properties.","Chemical communications (Cambridge, England)","2021","57","69","8624","8627","10.1039/d1cc03262c","","","0.71073","MoKα","","0.0366","0.0305","","","0.0775","0.0811","","","","","","0.824","","","","has coordinates","268613","2021-09-06","09:46:27",""
"7128720","18.9931","0.0003","18.9931","0.0003","29.0291","0.0007","90","","90","","120","","9068.9","0.3","175","","175","","","","","","","","","5","P -3 1 c","-P 3 2c","163","","","","- Dy6 Fe2 Na6 Nb30 O151 -","- Dy6 Fe2 Na6 Nb30 O139 -","- Dy12 Fe4 Na12 Nb60 O278 -","2","0.166667","","Lin, Yu-Diao; Ge, Rui; Tian, Chong-Bin; Sun, Cai; Sun, Yan-Qiong; Zeng, Qing-Xin; Li, Xin-Xiong; Zheng, Shou-Tian","3d-4f Heterometallic cluster incorporated polyoxoniobates with magnetic properties.","Chemical communications (Cambridge, England)","2021","57","69","8624","8627","10.1039/d1cc03262c","","","0.71073","MoKα","","0.0456","0.0361","","","0.109","0.1128","","","","","","1.076","","","","has coordinates","268613","2021-09-06","09:46:38",""
"7128721","19.0037","0.0003","19.0037","0.0003","28.6076","0.0011","90","","90","","120","","8947.2","0.4","175","","175","","","","","","","","","5","P -3 1 c","-P 3 2c","163","","","","- Co2 Dy6 Na6 Nb30 O141 -","- Co2 Dy6 Na6 Nb30 O141 -","- Co4 Dy12 Na12 Nb60 O282 -","2","0.166667","","Lin, Yu-Diao; Ge, Rui; Tian, Chong-Bin; Sun, Cai; Sun, Yan-Qiong; Zeng, Qing-Xin; Li, Xin-Xiong; Zheng, Shou-Tian","3d-4f Heterometallic cluster incorporated polyoxoniobates with magnetic properties.","Chemical communications (Cambridge, England)","2021","57","69","8624","8627","10.1039/d1cc03262c","","","0.71073","MoKα","","0.0392","0.0331","","","0.0744","0.0768","","","","","","1.012","","","","has coordinates","268613","2021-09-06","09:46:38",""
"7128722","8.9234","0.0007","21.4147","0.0019","12.0958","0.001","90","","98.627","0.007","90","","2285.3","0.3","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H22 O2 S -","- C30 H22 O2 S -","- C120 H88 O8 S4 -","4","1","","Shibata, Takanori; Sekine, Ayato; Akino, Mika; Ito, Mamoru","Ni-catalyzed non-activated C-S bond cleavage at ambient temperature for the synthesis of sulfur-containing polycyclic compounds.","Chemical communications (Cambridge, England)","2021","57","72","9048","9051","10.1039/d1cc03226g","","","0.71075","MoKα","","0.0967","0.0673","","","0.1992","0.2208","","","","","","1.135","","","","has coordinates","269664","2021-10-06","14:03:05",""
"7128723","10.93","0.0002","13.8562","0.0003","26.031","0.0005","90","","100.882","0.007","90","","3871.46","0.16","173","","173","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C44 H36 S2 -","- C44 H36 S2 -","- C176 H144 S8 -","4","1","","Shibata, Takanori; Sekine, Ayato; Akino, Mika; Ito, Mamoru","Ni-catalyzed non-activated C-S bond cleavage at ambient temperature for the synthesis of sulfur-containing polycyclic compounds.","Chemical communications (Cambridge, England)","2021","57","72","9048","9051","10.1039/d1cc03226g","","","1.54187","CuKα","","0.1098","0.0941","","","0.2896","0.3046","","","","","","1.123","","","","has coordinates","269664","2021-10-06","14:03:09",""
"7128724","7.5599","0.0003","15.0534","0.0006","17.4891","0.0007","105.364","0.007","95.79","0.007","99.56","0.007","1870.42","0.16","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C50 H38 O2 S2 -","- C50 H38 O2 S2 -","- C100 H76 O4 S4 -","2","1","","Shibata, Takanori; Sekine, Ayato; Akino, Mika; Ito, Mamoru","Ni-catalyzed non-activated C-S bond cleavage at ambient temperature for the synthesis of sulfur-containing polycyclic compounds.","Chemical communications (Cambridge, England)","2021","57","72","9048","9051","10.1039/d1cc03226g","","","1.54187","CuKα","","0.2115","0.126","","","0.205","0.2387","","","","","","1.01","","","","has coordinates","269664","2021-10-06","14:03:22",""
"7128725","29.023","0.017","6.531","0.004","23.003","0.013","90","","117.121","0.006","90","","3881","4","296","2","296.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H30 Ag1.25 Cu0.75 S2 -","- C20 H30 Ag1.248 Cu0.752 S2 -","- C160 H240 Ag9.984 Cu6.016 S16 -","8","1","","Ke, Feng; Zhou, Chuanjun; Zheng, Mengke; Li, Hao; Bao, Junjie; Zhu, Chen; Song, Yongbo; Xu, Wen Wu; Zhu, Manzhou","The alloying-induced electrical conductivity of metal-chalcogenolate nanowires.","Chemical communications (Cambridge, England)","2021","57","70","8774","8777","10.1039/d1cc01849c","","","0.71073","MoKα","","0.0752","0.0434","","","0.1073","0.1206","","","","","","1.048","","","","has coordinates,has disorder","268505","2021-09-06","09:02:31",""
"7128726","11.6181","0.0002","14.4247","0.0003","31.3601","0.0008","90","","92.474","0.001","90","","5250.7","0.2","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C55 H50 Cl2 F3 Ir O9 P2 S -","- C55 H50 Cl2 F3 Ir O9 P2 S -","- C220 H200 Cl8 F12 Ir4 O36 P8 S4 -","4","1","","Li, Jinhua; Lu, Zhengyu; Hua, Yuhui; Chen, Dafa; Xia, Haiping","Carbolong chemistry: nucleophilic aromatic substitution of a triflate functionalized iridapentalene.","Chemical communications (Cambridge, England)","2021","57","68","8464","8467","10.1039/d1cc03261e","","","0.71073","MoKα","","0.0508","0.0337","","","0.0621","0.0691","","","","","","1.04","","","","has coordinates","268558","2021-09-06","09:17:33",""
"7128727","11.7694","0.0005","14.4795","0.0006","17.2788","0.0007","99.712","0.002","91.494","0.002","95.634","0.002","2885.6","0.2","100","2","100","","","","","","","","","8","P -1","-P 1","2","","","","- C66 H57 F3 Ir N O8 P2 S -","- C66 H57 F3 Ir N O8 P2 S -","- C132 H114 F6 Ir2 N2 O16 P4 S2 -","2","1","","Li, Jinhua; Lu, Zhengyu; Hua, Yuhui; Chen, Dafa; Xia, Haiping","Carbolong chemistry: nucleophilic aromatic substitution of a triflate functionalized iridapentalene.","Chemical communications (Cambridge, England)","2021","57","68","8464","8467","10.1039/d1cc03261e","","","1.54178","CuKα","","0.0475","0.047","","","0.1233","0.1238","","","","","","1.093","","","","has coordinates","268558","2021-09-06","09:17:33",""
"7128728","11.8748","0.0009","15.7834","0.0011","16.8217","0.0011","66.142","0.003","82.914","0.003","83.728","0.003","2855.2","0.4","106","2","106","","","","","","","","","8","P -1","-P 1","2","","","","- C60 H52 Cl2 F3 Ir O8 P2 S2 -","- C60 H52 Cl2 F3 Ir O8 P2 S2 -","- C120 H104 Cl4 F6 Ir2 O16 P4 S4 -","2","1","","Li, Jinhua; Lu, Zhengyu; Hua, Yuhui; Chen, Dafa; Xia, Haiping","Carbolong chemistry: nucleophilic aromatic substitution of a triflate functionalized iridapentalene.","Chemical communications (Cambridge, England)","2021","57","68","8464","8467","10.1039/d1cc03261e","","x-ray","1.54184","CuKα","","0.0299","0.0288","","","0.0735","0.0742","","","","","","1.031","","","","has coordinates","268558","2021-09-06","09:17:33",""
"7128729","12.2983","0.0006","21.2345","0.0011","23.5769","0.0013","90","","95.003","0.003","90","","6133.6","0.6","100","","100","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C64 H53 F3 Ir N O8 P2 S -","- C64 H53 F3 Ir N O8 P2 S -","- C256 H212 F12 Ir4 N4 O32 P8 S4 -","4","1","","Li, Jinhua; Lu, Zhengyu; Hua, Yuhui; Chen, Dafa; Xia, Haiping","Carbolong chemistry: nucleophilic aromatic substitution of a triflate functionalized iridapentalene.","Chemical communications (Cambridge, England)","2021","57","68","8464","8467","10.1039/d1cc03261e","","","1.54178","CuKα","","0.0641","0.0525","","","0.1468","0.1537","","","","","","1.079","","","","has coordinates,has disorder","268558","2021-09-06","09:17:33",""
"7128730","12.2728","0.0002","12.9648","0.0002","19.7289","0.0003","92.928","0.001","96.042","0.001","109.139","0.001","2936.9","0.08","529","2","529","","","","","","","","","10","P -1","-P 1","2","","","","- C61 H50 Br Cl2 F3 Ir N O8 P2 S -","- C61 H50 Br Cl2 F3 Ir N O8 P2 S -","- C122 H100 Br2 Cl4 F6 Ir2 N2 O16 P4 S2 -","2","1","","Li, Jinhua; Lu, Zhengyu; Hua, Yuhui; Chen, Dafa; Xia, Haiping","Carbolong chemistry: nucleophilic aromatic substitution of a triflate functionalized iridapentalene.","Chemical communications (Cambridge, England)","2021","57","68","8464","8467","10.1039/d1cc03261e","","","1.54178","CuKα","","0.0387","0.0357","","","0.0887","0.0901","","","","","","1.084","","","","has coordinates","268558","2021-09-06","09:17:33",""
"7128731","13.3075","0.0004","14.237","0.0005","14.8738","0.0005","87.574","0.001","78.577","0.001","86.178","0.001","2754.79","0.16","100","2","99.99","","","","","","","","","9","P -1","-P 1","2","","","","- C61 H51 Cl2 F3 Ir N O9 P2 S -","- C61 H51 Cl2 F3 Ir N O8 P2 S -","- C122 H102 Cl4 F6 Ir2 N2 O16 P4 S2 -","2","1","","Li, Jinhua; Lu, Zhengyu; Hua, Yuhui; Chen, Dafa; Xia, Haiping","Carbolong chemistry: nucleophilic aromatic substitution of a triflate functionalized iridapentalene.","Chemical communications (Cambridge, England)","2021","57","68","8464","8467","10.1039/d1cc03261e","","","0.71073","MoKα","","0.0647","0.051","","","0.1258","0.1387","","","","","","1.051","","","","has coordinates,has disorder","268558","2021-09-06","09:17:33",""
"7128732","10.7506","0.0002","22.5712","0.0005","23.8255","0.0005","87.625","0.001","77.286","0.001","81.93","0.001","5583.4","0.2","100","2","100","","","","","","","","","9","P -1","-P 1","2","","","","- C123 H100 Cl2 F6 Ir2 N2 O18 P4 S2 -","- C123 H100 Cl2 F6 Ir2 N2 O18 P4 S2 -","- C246 H200 Cl4 F12 Ir4 N4 O36 P8 S4 -","2","1","","Li, Jinhua; Lu, Zhengyu; Hua, Yuhui; Chen, Dafa; Xia, Haiping","Carbolong chemistry: nucleophilic aromatic substitution of a triflate functionalized iridapentalene.","Chemical communications (Cambridge, England)","2021","57","68","8464","8467","10.1039/d1cc03261e","","","1.54178","CuKα","","0.0494","0.0476","","","0.1117","0.1124","","","","","","1.167","","","","has coordinates","268558","2021-09-06","09:17:33",""
"7128733","27.825","0.004","27.825","0.004","44.321","0.008","90","","90","","120","","29717","8","100","","100","","","","","","","","","8","P -3 c 1","-P 3 2""c","165","","","","- C258 H192 B8 F32 N24 O26 P4 Zn4 -","- C258.15 H192.3 B8 F32 N24 O26.05 P4 Zn4 -","- C1032.6 H769.2 B32 F128 N96 O104.2 P16 Zn16 -","4","0.333333","","Yamamura, Masaki; Saito, Tsuyoshi; Hasegawa, Toru; Nishibori, Eiji; Nabeshima, Tatsuya","Synthesis of a chiral metallo-capsule composed of concave molecules and chirogenesis upon fullerene binding.","Chemical communications (Cambridge, England)","2021","57","70","8754","8757","10.1039/d1cc02341a","","","0.8","","","0.1575","0.1393","","","0.3866","0.4107","","","","","","1.471","","","","has coordinates","268502","2021-09-06","09:00:01",""
"7128734","9.2828","0.001","12.509","0.0014","12.9773","0.0014","118.226","0.001","96.392","0.001","94.616","0.001","1304.1","0.2","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H28 B N7 -","- C30 H28 B N7 -","- C60 H56 B2 N14 -","2","1","","Patrick, Evan A.; Yang, Yan; Piers, Warren E.; Maron, Laurent; Gelfand, Benjamin S.","A monoanionic pentadentate ligand platform for scandium-pnictogen multiple bonds.","Chemical communications (Cambridge, England)","2021","57","69","8640","8643","10.1039/d1cc03481b","","","0.71073","MoKα","","0.0602","0.0439","","","0.1032","0.1146","","","","","","1.019","","","","has coordinates","268612","2021-09-06","09:44:44",""
"7128735","8.397","0.0018","10.808","0.002","24.445","0.005","93.476","0.006","95.859","0.007","91.758","0.006","2201.3","0.8","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C47 H56 B N7 P Sc -","- C47 H56 B N7 P Sc -","- C94 H112 B2 N14 P2 Sc2 -","2","1","","Patrick, Evan A.; Yang, Yan; Piers, Warren E.; Maron, Laurent; Gelfand, Benjamin S.","A monoanionic pentadentate ligand platform for scandium-pnictogen multiple bonds.","Chemical communications (Cambridge, England)","2021","57","69","8640","8643","10.1039/d1cc03481b","","x-ray","1.54178","CuKα","","0.0375","0.0359","","","0.0949","0.0962","","","","","","1.046","","","","has coordinates,has disorder","268612","2021-09-06","09:44:46",""
"7128736","17.942","0.0013","20.4968","0.0017","26.1685","0.0019","90","","93.504","0.005","90","","9605.6","1.3","273","2","273.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H44 B N8 Sc -","- C42 H44 B N8 Sc -","- C336 H352 B8 N64 Sc8 -","8","1","","Patrick, Evan A.; Yang, Yan; Piers, Warren E.; Maron, Laurent; Gelfand, Benjamin S.","A monoanionic pentadentate ligand platform for scandium-pnictogen multiple bonds.","Chemical communications (Cambridge, England)","2021","57","69","8640","8643","10.1039/d1cc03481b","","","1.54178","CuKα","","0.0884","0.0639","","","0.1815","0.1954","","","","","","1.054","","","","has coordinates","268612","2021-09-06","09:44:46",""
"7128737","8.7025","0.0003","12.7011","0.0004","21.2188","0.001","90.965","0.003","91.117","0.003","101.418","0.002","2297.98","0.15","173","","173","","","","","","","","","7","P -1","-P 1","2","","","","- C50 H50 B N7 O4 P Sc -","- C50 H50 B N7 O4 P Sc -","- C100 H100 B2 N14 O8 P2 Sc2 -","2","1","","Patrick, Evan A.; Yang, Yan; Piers, Warren E.; Maron, Laurent; Gelfand, Benjamin S.","A monoanionic pentadentate ligand platform for scandium-pnictogen multiple bonds.","Chemical communications (Cambridge, England)","2021","57","69","8640","8643","10.1039/d1cc03481b","","x-ray","1.54178","CuKα","","0.0652","0.0528","","","0.1284","0.1355","","","","","","1.058","","","","has coordinates,has disorder","268612","2021-09-06","09:44:46",""
"7128738","7.7589","0.0012","9.054","0.002","37.137","0.007","90","","94.835","0.006","90","","2599.6","0.9","140","2","140","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H33 N3 O2 S -","- C29 H33 N3 O2 S -","- C116 H132 N12 O8 S4 -","4","1","","Zhang, Jun; Wang, Mengmeng; Wang, Huiying; Xu, Hui; Chen, Junjie; Guo, Ziqiong; Ma, Biao; Ban, Shu-Rong; Dai, Hui-Xiong","Construction of 2-alkynyl aza-spiro[4,5]indole scaffolds via sequential C-H activations for modular click chemistry libraries.","Chemical communications (Cambridge, England)","2021","57","69","8656","8659","10.1039/d1cc02798k","","","0.71073","MoKα","","0.1223","0.095","","","0.2583","0.2882","","","","","","1.039","","","","has coordinates","268616","2021-09-06","09:52:27",""
"7128739","4.768","0.002","18.775","0.009","31.234","0.015","90","","90","","90","","2796","2","120","2","120","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","Eupomatenoid-6","(E)-4-[3-methyl-5-(prop-1-en-1-yl)benzofuran-2-yl]phenol","","- C18 H16 O2 -","- C18 H16 O2 -","- C144 H128 O16 -","8","1","","Fujita, Takeshi; Morioka, Ryutaro; Fukuda, Takuya; Suzuki, Naoto; Ichikawa, Junji","Acid-mediated intermolecular C-F/C-H cross-coupling of 2-fluorobenzofurans with arenes: synthesis of 2-arylbenzofurans.","Chemical communications (Cambridge, England)","2021","57","68","8500","8503","10.1039/d1cc03453g","","","0.71073","MoKα","","0.1546","0.0884","","","0.1791","0.204","","","","","","1.079","","","","has coordinates","268565","2021-09-06","09:29:31",""
"7128740","9.5627","0.0012","9.869","0.0013","12.5518","0.0016","99.428","0.002","91.22","0.002","90.737","0.002","1168.1","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H25 N O4 S -","- C28 H25 N O4 S -","- C56 H50 N2 O8 S2 -","2","1","","Liu, Dan; Shi, Bin; Jiang, Hao; Cheng, Ying; Xiao, Wen-Jing; Lu, Liang-Qiu","Synthesis of hydroindoles via desymmetric [3+2] cycloadditions of para-quinamines with photogenerated ketenes.","Chemical communications (Cambridge, England)","2021","57","68","8496","8499","10.1039/d1cc03352b","","","0.71073","MoKα","","0.0728","0.0471","","","0.1229","0.1575","","","","","","1.063","","","","has coordinates","268563","2021-09-06","09:29:00",""
"7128741","7.6078","0.00015","9.1979","0.0002","13.39653","0.00018","90","","90","","90","","937.43","0.03","100.02","0.1","100.02","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C9 H14 O3 -","- C9 H14 O3 -","- C36 H56 O12 -","4","1","","Miyazawa, Takeshi; Fitzgerald, Brendan J.; Keatinge-Clay, Adrian T","Preparative production of an enantiomeric pair by engineered polyketide synthases.","Chemical communications (Cambridge, England)","2021","57","70","8762","8765","10.1039/d1cc03073f","","x-ray","1.54184","CuKα","","0.0281","0.0277","","","0.0732","0.0738","","","","","","1.127","","","","has coordinates","268501","2021-09-06","08:59:34",""
"7128742","7.608","0.0002","9.2035","0.0003","13.3936","0.0003","90","","90","","90","","937.82","0.04","100.02","0.1","100.02","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C9 H14 O3 -","- C9 H14 O3 -","- C36 H56 O12 -","4","1","","Miyazawa, Takeshi; Fitzgerald, Brendan J.; Keatinge-Clay, Adrian T","Preparative production of an enantiomeric pair by engineered polyketide synthases.","Chemical communications (Cambridge, England)","2021","57","70","8762","8765","10.1039/d1cc03073f","","x-ray","1.54184","CuKα","","0.0307","0.03","","","0.0789","0.0797","","","","","","1.112","","","","has coordinates","268501","2021-09-06","08:59:44",""
"7128743","12.1982","0.0016","8.3863","0.0011","17.209","0.002","90","","107.749","0.005","90","","1676.6","0.4","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 N2 S -","- C22 H16 N2 S -","- C88 H64 N8 S4 -","4","1","","Chen, Song; Li, Ya-Nan; Xiang, Shao-Hua; Li, Shaoyu; Tan, Bin","Electrochemical phenothiazination of naphthylamines and its application in photocatalysis.","Chemical communications (Cambridge, England)","2021","57","68","8512","8515","10.1039/d1cc03276c","","x-ray","1.54178","CuKα","","0.0359","0.0353","","","0.0973","0.0978","","","","","","1.065","","","","has coordinates","268566","2021-09-06","09:29:39",""
"7128744","13.9618","0.0005","8.6489","0.0003","26.7485","0.001","90","","90","","90","","3230","0.2","100","","100","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C22 H16 N2 S -","- C22 H16 N2 S -","- C176 H128 N16 S8 -","8","2","","Chen, Song; Li, Ya-Nan; Xiang, Shao-Hua; Li, Shaoyu; Tan, Bin","Electrochemical phenothiazination of naphthylamines and its application in photocatalysis.","Chemical communications (Cambridge, England)","2021","57","68","8512","8515","10.1039/d1cc03276c","","x-ray","0.71073","MoKα","","0.0479","0.0424","","","0.1069","0.1111","","","","","","1.036","","","","has coordinates","268566","2021-09-06","09:29:39",""
"7128745","8.34646","0.00016","28.3786","0.0005","8.67019","0.00014","90","","94.7923","0.0018","90","","2046.45","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H19 N O3 -","- C22 H19 N O3 -","- C88 H76 N4 O12 -","4","1","","Han, Tian-Jiao; Wang, Min-Can; Mei, Guang-Jian","2-Indolymethanols as 4-atom-synthons in oxa-Michael reaction cascade: access to tetracyclic indoles.","Chemical communications (Cambridge, England)","2021","57","71","8921","8924","10.1039/d1cc03653j","","x-ray","1.54184","CuKα","","0.0625","0.0493","","","0.1455","0.1591","","","","","","1.034","","","","has coordinates","269657","2021-10-06","14:00:41",""
"7128746","8.1529","0.0006","30.7743","0.0011","8.7822","0.0004","90","","95.2","0.005","90","","2194.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 Br N O3 -","- C22 H18 Br N O3 -","- C88 H72 Br4 N4 O12 -","4","1","","Han, Tian-Jiao; Wang, Min-Can; Mei, Guang-Jian","2-Indolymethanols as 4-atom-synthons in oxa-Michael reaction cascade: access to tetracyclic indoles.","Chemical communications (Cambridge, England)","2021","57","71","8921","8924","10.1039/d1cc03653j","","x-ray","1.54184","CuKα","","0.0755","0.0578","","","0.1529","0.1675","","","","","","1.038","","","","has coordinates,has disorder","269657","2021-10-06","14:00:44",""
"7128747","12.0027","0.0004","16.9978","0.0005","21.5539","0.0007","90","","90.59","0.001","90","","4397.2","0.2","100","","100","","","","","","","","","8","C 1 c 1","C -2yc","9","","","","- C18 H40 Al F20 O4 P Si4 Te4 -","- C18 H40 Al F20 O4 P Si4 Te4 -","- C72 H160 Al4 F80 O16 P4 Si16 Te16 -","4","1","","Fischer, Lukas; Wossidlo, Friedrich; Frost, Daniel; Coles, Nathan T.; Steinhauer, Simon; Riedel, Sebastian; Müller, Christian","One-step methylation of aromatic phosphorus heterocycles: synthesis and crystallographic characterization of a 1-methyl-phosphininium salt.","Chemical communications (Cambridge, England)","2021","57","75","9522","9525","10.1039/d1cc03892c","","","0.71073","MoKα","","0.018","0.0174","","","0.0416","0.0421","","","","","","1.048","","","","has coordinates","269644","2021-10-06","13:56:52",""
"7128748","11.0213","0.0005","11.8221","0.0005","18.3959","0.0007","90","","90","","90","","2396.89","0.17","100","","100","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C17 H37 P Si4 -","- C17 H37 P Si4 -","- C68 H148 P4 Si16 -","4","0.5","","Fischer, Lukas; Wossidlo, Friedrich; Frost, Daniel; Coles, Nathan T.; Steinhauer, Simon; Riedel, Sebastian; Müller, Christian","One-step methylation of aromatic phosphorus heterocycles: synthesis and crystallographic characterization of a 1-methyl-phosphininium salt.","Chemical communications (Cambridge, England)","2021","57","75","9522","9525","10.1039/d1cc03892c","","","0.71073","MoKα","","0.0375","0.0326","","","0.0808","0.0849","","","","","","1.245","","","","has coordinates,has disorder","269644","2021-10-06","13:56:56",""
"7128749","12.1589","0.0009","12.2886","0.0009","13.5265","0.001","81.017","0.007","89.628","0.008","71.449","0.006","1890.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(Z)-12-tosyl-12,13-dihydro-11H-dibenzo[c,h][1,2,6]triazonine","","- C21 H19 N3 O2 S -","- C21 H19 N3 O2 S -","- C84 H76 N12 O8 S4 -","4","2","","Goual, Nawel; Casimiro, Lorenzo; Delattre, Vincent; Retailleau, Pascal; Maisonneuve, Stéphane; Bogliotti, Nicolas; Métivier, Rémi; Xie, Juan; Marinetti, Angela; Voituriez, Arnaud","Triazonine-based bistable photoswitches: synthesis, characterization and photochromic properties.","Chemical communications (Cambridge, England)","2021","57","78","10079","10082","10.1039/d1cc02746h","","x-ray","0.71073","MoKα","","0.0459","0.0408","","","0.118","0.1217","","","","","","1.064","","","","has coordinates","269603","2021-10-06","13:41:51",""
"7128750","13.7733","0.0004","10.3424","0.0003","12.3133","0.0004","90","","91.874","0.003","90","","1753.08","0.09","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","tert-butyl(E)-11,13-dihydro-12H-dibenzo[c,h][1,2,6]triazonine-12-carboxylate","","- C19 H21 N3 O2 -","- C19 H21 N3 O2 -","- C76 H84 N12 O8 -","4","1","","Goual, Nawel; Casimiro, Lorenzo; Delattre, Vincent; Retailleau, Pascal; Maisonneuve, Stéphane; Bogliotti, Nicolas; Métivier, Rémi; Xie, Juan; Marinetti, Angela; Voituriez, Arnaud","Triazonine-based bistable photoswitches: synthesis, characterization and photochromic properties.","Chemical communications (Cambridge, England)","2021","57","78","10079","10082","10.1039/d1cc02746h","","x-ray","0.71073","MoKα","","0.0587","0.053","","","0.1384","0.1444","","","","","","1.072","","","","has coordinates,has disorder","269603","2021-10-06","13:41:52",""
"7128751","5.0393","0.0003","11.5613","0.0006","26.3881","0.0015","90","","90","","90","","1537.39","0.15","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","'ethyl (E)-11,13-dihydro-12H-dibenzo[c,h][1,2,6]triazonine-12-carboxylate'","","- C17 H17 N3 O2 -","- C17 H17 N3 O2 -","- C68 H68 N12 O8 -","4","1","","Goual, Nawel; Casimiro, Lorenzo; Delattre, Vincent; Retailleau, Pascal; Maisonneuve, Stéphane; Bogliotti, Nicolas; Métivier, Rémi; Xie, Juan; Marinetti, Angela; Voituriez, Arnaud","Triazonine-based bistable photoswitches: synthesis, characterization and photochromic properties.","Chemical communications (Cambridge, England)","2021","57","78","10079","10082","10.1039/d1cc02746h","","x-ray","0.71073","MoKα","","0.0498","0.0384","","","0.0931","0.0985","","","","","","1.058","","","","has coordinates","269603","2021-10-06","13:41:52",""
"7128752","12.2994","0.0004","9.158","0.0003","26.4451","0.001","90","","90","","90","","2978.72","0.18","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","'ethyl (Z)-11,13-dihydro-12H-dibenzo[c,h][1,2,6]triazonine-12-carboxylate'","","- C17 H17 N3 O2 -","- C17 H17 N3 O2 -","- C136 H136 N24 O16 -","8","1","","Goual, Nawel; Casimiro, Lorenzo; Delattre, Vincent; Retailleau, Pascal; Maisonneuve, Stéphane; Bogliotti, Nicolas; Métivier, Rémi; Xie, Juan; Marinetti, Angela; Voituriez, Arnaud","Triazonine-based bistable photoswitches: synthesis, characterization and photochromic properties.","Chemical communications (Cambridge, England)","2021","57","78","10079","10082","10.1039/d1cc02746h","","x-ray","0.71073","MoKα","","0.0435","0.0397","","","0.1035","0.106","","","","","","1.022","","","","has coordinates","269603","2021-10-06","13:41:52",""
"7128753","9.4527","0.0002","11.1113","0.0003","17.2833","0.0005","72.18","0.002","86.927","0.002","81.304","0.002","1708.28","0.08","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","'tert-butyl(Z)-11,13-dihydro-12H-dibenzo[c,h][1,2,6]triazonine-12-carboxylate'","","- C19 H21 N3 O2 -","- C19 H21 N3 O2 -","- C76 H84 N12 O8 -","4","2","","Goual, Nawel; Casimiro, Lorenzo; Delattre, Vincent; Retailleau, Pascal; Maisonneuve, Stéphane; Bogliotti, Nicolas; Métivier, Rémi; Xie, Juan; Marinetti, Angela; Voituriez, Arnaud","Triazonine-based bistable photoswitches: synthesis, characterization and photochromic properties.","Chemical communications (Cambridge, England)","2021","57","78","10079","10082","10.1039/d1cc02746h","","x-ray","0.71073","MoKα","","0.0569","0.0448","","","0.1149","0.1217","","","","","","1.047","","","","has coordinates","269603","2021-10-06","13:41:52",""
"7128754","8.7639","0.0002","14.1232","0.0003","14.1951","0.0004","116.403","0.002","90.929","0.002","104.547","0.002","1506.6","0.07","150","2","150","0.16","","","","","","","","6","P -1","-P 1","2","","","","- C31 H44 Cl2 O Si Ti -","- C31 H44 Cl2 O Si Ti -","- C62 H88 Cl4 O2 Si2 Ti2 -","2","1","","Collins Rice, Clement G.; Buffet, Jean-Charles; Turner, Zoë R; O'Hare, Dermot","Supported permethylindenyl titanium catalysts for the synthesis of disentangled ultra-high molecular weight polyethylene (disUHMWPE).","Chemical communications (Cambridge, England)","2021","57","69","8600","8603","10.1039/d1cc03418a","","x-ray","1.54184","CuKα","","0.0468","0.0428","","","0.1161","0.1221","","","","","","1.037","","","","has coordinates","268609","2021-09-06","09:42:45",""
"7128755","14.8873","0.0003","14.8873","0.0003","13.6624","0.0004","90","","90","","90","","3028.02","0.12","223","100","223","100","","","","","","","","6","P 41","P 4w","76","","","","- C33 H23 F3 N2 O3 S -","- C33 H23 F3 N2 O3 S -","- C132 H92 F12 N8 O12 S4 -","4","1","","Yan, Ru-Jie; Liu, Bao-Xin; Hu, Yuan; Du, Wei; Chen, Ying-Chun","Generation of zwitterionic trifluoromethyl <i>N</i>-allylic ylides and their use in switchable divergent annulations.","Chemical communications (Cambridge, England)","2021","57","72","9056","9059","10.1039/d1cc03830c","","x-ray","1.54184","CuKα","","0.0798","0.0789","","","0.1983","0.2009","","","","","","1.055","","","","has coordinates","269663","2021-10-06","14:02:47",""
"7128756","11.71838","0.00015","13.40753","0.00016","18.3196","0.0002","90","","90","","90","","2878.28","0.06","204","6","204","6","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C33 H23 F3 N2 O2 S2 -","- C33 H23 F3 N2 O2 S2 -","- C132 H92 F12 N8 O8 S8 -","4","1","","Yan, Ru-Jie; Liu, Bao-Xin; Hu, Yuan; Du, Wei; Chen, Ying-Chun","Generation of zwitterionic trifluoromethyl <i>N</i>-allylic ylides and their use in switchable divergent annulations.","Chemical communications (Cambridge, England)","2021","57","72","9056","9059","10.1039/d1cc03830c","","x-ray","1.54184","CuKα","","0.0512","0.0497","","","0.1267","0.1289","","","","","","1.057","","","","has coordinates","269663","2021-10-06","14:02:47",""
"7128757","8.6266","0.0007","18.4175","0.0016","19.2928","0.0017","90","","90","","90","","3065.2","0.5","273.15","","273.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C34 H22 F3 N3 O2 S3 -","- C34 H22 F3 N3 O2 S3 -","- C136 H88 F12 N12 O8 S12 -","4","1","","Yan, Ru-Jie; Liu, Bao-Xin; Hu, Yuan; Du, Wei; Chen, Ying-Chun","Generation of zwitterionic trifluoromethyl <i>N</i>-allylic ylides and their use in switchable divergent annulations.","Chemical communications (Cambridge, England)","2021","57","72","9056","9059","10.1039/d1cc03830c","","","0.71073","MoKα","","0.1304","0.0571","","","0.1181","0.1485","","","","","","1.006","","","","has coordinates","269663","2021-10-06","14:02:47",""
"7128758","11.683","0.0001","11.683","0.0001","39.0801","0.0003","90","","90","","90","","5334.14","0.08","301","0.1","301","0.1","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C28 H29 I N2 O6 -","- C28 H29 I N2 O6 -","- C224 H232 I8 N16 O48 -","8","1","","Shi, Wei-Yu; Ding, Ya-Nan; Zheng, Nian; Gou, Xue-Ya; Zhang, Zhe; Chen, Xi; Luan, Yu-Yong; Niu, Zhi-Jie; Liang, Yong-Min","Highly regioselective and stereoselective synthesis of C-Aryl glycosides <i>via</i> nickel-catalyzed <i>ortho</i>-C-H glycosylation of 8-aminoquinoline benzamides.","Chemical communications (Cambridge, England)","2021","57","71","8945","8948","10.1039/d1cc03589d","","x-ray","1.54184","CuKα","","0.0273","0.0248","","","0.0616","0.0627","","","","","","1.047","","","","has coordinates","269655","2021-10-06","14:00:06",""
"7128759","15.1578","0.0005","15.1578","0.0005","31.4738","0.0012","90","","90","","120","","6262.6","0.4","120","0.2","120","0.2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C48 H97 Cl8 Fe15 N8 O39 -","- C48 H97.0002 Cl8 Fe15 N8 O39.0002 -","- C144 H291.001 Cl24 Fe45 N24 O117.001 -","3","0.166667","","Cutler, Daniel J.; Singh, Mukesh K.; Nichol, Gary S.; Evangelisti, Marco; Schnack, Jürgen; Cronin, Leroy; Brechin, Euan K.","[Fe<sub>15</sub>]: a frustrated, centred tetrakis hexahedron.","Chemical communications (Cambridge, England)","2021","57","71","8925","8928","10.1039/d1cc03919a","","x-ray","0.71073","MoKα","","0.0756","0.0646","","","0.1348","0.14","","","","","","1.134","","","","has coordinates,has disorder","269661","2021-10-06","14:01:55",""
"7128760","10.7867","0.0004","3.95279","0.00013","21.358","0.0007","90","","90.388","0.006","90","","910.63","0.05","103","","103","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 1-oxo-1,2-dihydroisoquinoline-3-carboxylate","","- C11 H9 N O3 -","- C11 H9 N O3 -","- C44 H36 N4 O12 -","4","1","","Ardiansah, Bayu; Tanimoto, Hiroki; Tomohiro, Takenori; Morimoto, Tsumoru; Kakiuchi, Kiyomi","Sulfonium ion-promoted traceless Schmidt reaction of alkyl azides.","Chemical communications (Cambridge, England)","2021","57","70","8738","8741","10.1039/d1cc02770k","","","0.71075","MoKα","","0.0468","0.0431","","","0.118","0.1213","","","","","","1.09","","","","has coordinates","268506","2021-09-06","09:02:37",""
"7128761","9.0086","0.0007","8.6711","0.0005","21.5443","0.0016","90","","100.929","0.007","90","","1652.4","0.2","294.18","0.1","294.18","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 N O S -","- C21 H15 N O S -","- C84 H60 N4 O4 S4 -","4","1","","Ji, Meishan; Chang, Chenyang; Wu, Xinxin; Zhu, Chen","Photocatalytic intermolecular carboarylation of alkenes by selective C-O bond cleavage of diarylethers.","Chemical communications (Cambridge, England)","2021","57","73","9240","9243","10.1039/d1cc04038c","","","0.71073","MoKα","","0.1492","0.1216","","","0.3118","0.3322","","","","","","1.047","","","","has coordinates","269619","2021-10-06","13:48:13",""
"7128762","21.678","0.006","13.712","0.004","15.918","0.005","90","","90","","90","","4732","2","296.15","","296.15","","","","","","","","","7","P m n a","-P 2ac 2","53","","","","- C34 H28 Cl Mn2 N13 O8 S2 -","- C34 H28 Cl Mn2 N13 O8 S2 -","- C136 H112 Cl4 Mn8 N52 O32 S8 -","4","0.5","","Dong, Long-Zhang; Zhang, Yu; Lu, Yun-Feng; Zhang, Lei; Huang, Xin; Wang, Jian-Hui; Liu, Jiang; Li, Shun-Li; Lan, Ya-Qian","A well-defined dual Mn-site based metal-organic framework to promote CO<sub>2</sub> reduction/evolution in Li-CO<sub>2</sub> batteries.","Chemical communications (Cambridge, England)","2021","57","71","8937","8940","10.1039/d1cc03431f","","","0.71073","MoKα","","0.1537","0.1289","","","0.2663","0.2821","","","","","","1.066","","","","has coordinates,has disorder","269654","2021-10-06","13:59:43",""
"7128763","22.1875","0.0012","13.4774","0.0007","15.9045","0.0009","90","","90","","90","","4755.9","0.4","296.15","","296.15","","","","","","","","","6","P m n a","-P 2ac 2","53","","","","- C34 H30 Co2 N13 O9 S2 -","- C34 H30 Co2 N13 O9 S2 -","- C136 H120 Co8 N52 O36 S8 -","4","0.5","","Dong, Long-Zhang; Zhang, Yu; Lu, Yun-Feng; Zhang, Lei; Huang, Xin; Wang, Jian-Hui; Liu, Jiang; Li, Shun-Li; Lan, Ya-Qian","A well-defined dual Mn-site based metal-organic framework to promote CO<sub>2</sub> reduction/evolution in Li-CO<sub>2</sub> batteries.","Chemical communications (Cambridge, England)","2021","57","71","8937","8940","10.1039/d1cc03431f","","","0.71073","MoKα","","0.0886","0.0602","","","0.1626","0.1829","","","","","","1.033","","","","has coordinates,has disorder","269654","2021-10-06","13:59:47",""
"7128764","22.29","0.02","13.477","0.012","15.919","0.016","90","","90","","90","","4782","8","296.15","","296.15","","","","","","","","","7","P m n a","-P 2ac 2","53","","","","- C34 H30 Co Mn N13 O9 S2 -","- C34 H30 Co Mn N13 O9 S2 -","- C136 H120 Co4 Mn4 N52 O36 S8 -","4","0.5","","Dong, Long-Zhang; Zhang, Yu; Lu, Yun-Feng; Zhang, Lei; Huang, Xin; Wang, Jian-Hui; Liu, Jiang; Li, Shun-Li; Lan, Ya-Qian","A well-defined dual Mn-site based metal-organic framework to promote CO<sub>2</sub> reduction/evolution in Li-CO<sub>2</sub> batteries.","Chemical communications (Cambridge, England)","2021","57","71","8937","8940","10.1039/d1cc03431f","","","0.71073","MoKα","","0.1198","0.0778","","","0.2087","0.248","","","","","","1.015","","","","has coordinates,has disorder","269654","2021-10-06","13:59:58",""
"7128765","14.391","0.0013","8.897","0.0008","36.446","0.003","90","","93.241","0.003","90","","4659","0.7","100","","100","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H10 Cl8 N2 O4 Si -","- C19 H10 Cl8 N2 O4 Si -","- C152 H80 Cl64 N16 O32 Si8 -","8","1","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.0564","0.0478","","","0.1161","0.122","","","","","","1.152","","","","has coordinates","268496","2021-09-06","08:53:18",""
"7128766","11.9675","0.0009","12.4047","0.001","16.8129","0.0013","94.06","0.003","106.632","0.003","117.844","0.003","2052.1","0.3","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C39 H25 Cl10 O5 P Si -","- C39 H25 Cl10 O5 P Si -","- C78 H50 Cl20 O10 P2 Si2 -","2","1","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.039","0.0331","","","0.0803","0.0843","","","","","","1.043","","","","has coordinates,has disorder","268496","2021-09-06","08:53:19",""
"7128767","12.6888","0.001","17.8472","0.0012","20.3151","0.0017","90","","90.872","0.003","90","","4600","0.6","100","","100","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C40 H28 Cl12 N O5 P Si -","- C40 H28 Cl12 N O5 P Si -","- C160 H112 Cl48 N4 O20 P4 Si4 -","4","1","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.0529","0.0361","","","0.0791","0.0879","","","","","","1.031","","","","has coordinates,has disorder","268496","2021-09-06","08:53:19",""
"7128768","15.162","0.002","16.186","0.002","18.463","0.003","109.982","0.005","90.192","0.005","107.734","0.006","4026.6","1","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C36.5 H21 Cl9 N O5 P Si -","- C36.5 H21 Cl9 N O5 P Si -","- C146 H84 Cl36 N4 O20 P4 Si4 -","4","2","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.1742","0.0827","","","0.2036","0.2379","","","","","","1.045","","","","has coordinates","268496","2021-09-06","08:53:19",""
"7128769","12.5198","0.0017","12.5964","0.0018","12.8616","0.0017","63.404","0.005","83.62","0.005","86.982","0.005","1802.5","0.4","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C29 H14 Cl8 N O4 P Si -","- C29 H14 Cl8 N O4 P Si -","- C58 H28 Cl16 N2 O8 P2 Si2 -","2","1","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.0976","0.0535","","","0.1175","0.1364","","","","","","1.001","","","","has coordinates","268496","2021-09-06","08:53:19",""
"7128770","16.942","0.003","12.536","0.003","15.917","0.003","90","","112.19","0.03","90","","3130.2","1.3","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 Cl12 N2 O4 Si -","- C22 H16 Cl12 N2 O4 Si -","- C88 H64 Cl48 N8 O16 Si4 -","4","1","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.1155","0.056","","","0.1111","0.13","","","","","","1.026","","","","has coordinates","268496","2021-09-06","08:53:19",""
"7128771","8.4949","0.0008","8.5627","0.0007","11.6916","0.0009","110.389","0.003","91.093","0.003","90.987","0.004","796.75","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H26 Cl8 N6 O4 Si -","- C26 H26 Cl8 N6 O4 Si -","- C26 H26 Cl8 N6 O4 Si -","1","0.5","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.0422","0.0362","","","0.0921","0.095","","","","","","1.065","","","","has coordinates","268496","2021-09-06","08:53:19",""
"7128772","11.1778","0.0008","11.9331","0.0009","17.3665","0.0012","83.309","0.003","88.887","0.002","67.403","0.003","2123.2","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C77 H46 Cl22 N2 O14 P2 Si2 -","- C77 H46 Cl22 N2 O14 P2 Si2 -","- C77 H46 Cl22 N2 O14 P2 Si2 -","1","0.5","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.0743","0.053","","","0.1134","0.1207","","","","","","1.055","","","","has coordinates,has disorder","268496","2021-09-06","08:53:19",""
"7128773","33.002","0.006","15.336","0.003","18.448","0.004","90","","119.585","0.007","90","","8120","3","100","","100","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C37 H22 Cl8 N O5 P Si -","- C37 H22 Cl8 N O5 P Si -","- C296 H176 Cl64 N8 O40 P8 Si8 -","8","1","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","","0.71073","MoKα","","0.0439","0.034","","","0.0856","0.0926","","","","","","1.026","","","","has coordinates","268496","2021-09-06","08:53:19",""
"7128774","14.3396","0.0013","9.8161","0.0011","18.6371","0.0017","90","","108.642","0.004","90","","2485.7","0.4","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H12 Cl8 N2 O5 Si -","- C20 H12 Cl8 N2 O5 Si -","- C80 H48 Cl32 N8 O20 Si4 -","4","1","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.1017","0.0629","","","0.1553","0.1854","","","","","","1.018","","","","has coordinates","268496","2021-09-06","08:53:19",""
"7128775","15.5399","0.0011","16.4844","0.0012","17.4224","0.0011","90","","90","","90","","4463","0.5","100","","100","","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C39 H26 Cl12 N O5 P Si -","- C39 H26 Cl12 N O5 P Si -","- C156 H104 Cl48 N4 O20 P4 Si4 -","4","1","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.0308","0.0269","","","0.0634","0.0654","","","","","","1.061","","","","has coordinates","268496","2021-09-06","08:53:19",""
"7128776","8.7056","0.0005","11.1906","0.0006","20.7094","0.001","77.511","0.002","89.089","0.002","75.072","0.002","1901.61","0.18","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C32 H20 Cl12 N O4 P Si -","- C32 H20 Cl12 N O4 P Si -","- C64 H40 Cl24 N2 O8 P2 Si2 -","2","1","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.0391","0.0312","","","0.0692","0.073","","","","","","1.028","","","","has coordinates","268496","2021-09-06","08:53:19",""
"7128777","13.35","0.02","14.77","0.04","16.46","0.03","86.32","0.07","78.14","0.03","82.12","0.07","3144","11","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C45 H25 Cl16 F N4 O9 Si2 -","- C45 H25 Cl16 F N4 O9 Si2 -","- C90 H50 Cl32 F2 N8 O18 Si4 -","2","1","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.1995","0.0858","","","0.1856","0.243","","","","","","0.939","","","","has coordinates","268496","2021-09-06","08:53:19",""
"7128778","23.136","0.004","12.559","0.002","24.311","0.004","90","","115.803","0.006","90","","6359.6","1.9","100","","100","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H16 Cl8 N O4 P Si -","- C30 H16 Cl8 N O4 P Si -","- C240 H128 Cl64 N8 O32 P8 Si8 -","8","2","","Hartmann, Deborah; Braner, Sven; Greb, Lutz","Bis(perchlorocatecholato)silane and heteroleptic bidonors: hidden frustrated Lewis pairs resulting from ring strain.","Chemical communications (Cambridge, England)","2021","57","69","8572","8575","10.1039/d1cc03452a","","x-ray","0.71073","MoKα","","0.1255","0.0956","","","0.1757","0.1971","","","","","","1.079","","","","has coordinates","268496","2021-09-06","08:53:19",""
"7128779","23.1321","0.0005","13.8142","0.0003","23.2907","0.0006","90","","112.711","0.001","90","","6865.5","0.3","193","2","193","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C128 H170 Ag2 Au2 F24 O2 P2 Sb4 -","- C128 H170 Ag2 Au2 F24 O2 P2 Sb4 -","- C256 H340 Ag4 Au4 F48 O4 P4 Sb8 -","2","0.5","","Navarro, Miquel; Miranda-Pizarro, Juan; Moreno, Juan J.; Navarro-Gilabert, Carlos; Fernández, Israel; Campos, Jesús","A dicoordinate gold(I)-ethylene complex.","Chemical communications (Cambridge, England)","2021","57","73","9280","9283","10.1039/d1cc02769g","","","0.71073","MoKα","","0.0569","0.046","","","0.1192","0.1261","","","","","","1.03","","","","has coordinates","269613","2021-10-06","13:46:35",""
"7128780","26.359","0.0007","20.0663","0.0006","26.8991","0.0007","90","","90","","90","","14227.7","0.7","193","2","193","2","","","","","","","","8","P c a 21","P 2c -2ac","29","","","","- C121 H145 Ag4 Au2 Cl2 F24 P2 Sb4 -","- C121 H143 Ag4 Au2 Cl4 F24 P2 Sb4 -","- C484 H572 Ag16 Au8 Cl16 F96 P8 Sb16 -","4","1","","Navarro, Miquel; Miranda-Pizarro, Juan; Moreno, Juan J.; Navarro-Gilabert, Carlos; Fernández, Israel; Campos, Jesús","A dicoordinate gold(I)-ethylene complex.","Chemical communications (Cambridge, England)","2021","57","73","9280","9283","10.1039/d1cc02769g","","","0.71073","MoKα","","0.074","0.0459","","","0.1094","0.1257","","","","","","1.033","","","","has coordinates,has disorder","269613","2021-10-06","13:46:36",""
"7128781","12.6896","0.0007","13.4566","0.0007","16.6155","0.0005","81.539","0.001","87.656","0.001","83.232","0.001","2786","0.2","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H75 Au Cl P -","- C60 H75 Au Cl P -","- C120 H150 Au2 Cl2 P2 -","2","1","","Navarro, Miquel; Miranda-Pizarro, Juan; Moreno, Juan J.; Navarro-Gilabert, Carlos; Fernández, Israel; Campos, Jesús","A dicoordinate gold(I)-ethylene complex.","Chemical communications (Cambridge, England)","2021","57","73","9280","9283","10.1039/d1cc02769g","","","0.71073","MoKα","","0.0413","0.0316","","","0.0868","0.0932","","","","","","0.955","","","","has coordinates,has disorder","269613","2021-10-06","13:46:36",""
"7128782","13.5895","0.0009","16.7018","0.0012","18.5193","0.0013","112.837","0.003","102.452","0.002","94.349","0.003","3722.8","0.5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C66 H87 Ag Au F12 O P Sb2 -","- C66 H87 Ag Au F12 O P Sb2 -","- C132 H174 Ag2 Au2 F24 O2 P2 Sb4 -","2","1","","Navarro, Miquel; Miranda-Pizarro, Juan; Moreno, Juan J.; Navarro-Gilabert, Carlos; Fernández, Israel; Campos, Jesús","A dicoordinate gold(I)-ethylene complex.","Chemical communications (Cambridge, England)","2021","57","73","9280","9283","10.1039/d1cc02769g","","","0.71073","MoKα","","0.0743","0.0509","","","0.1242","0.1388","","","","","","1.021","","","","has coordinates","269613","2021-10-06","13:46:36",""
"7128783","13.2698","0.0012","19.2125","0.0018","22.968","0.002","109.011","0.003","90.297","0.003","106.613","0.003","5273.8","0.8","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C94 H90 Au B F24 N P -","- C94 H90 Au B F24 N P -","- C188 H180 Au2 B2 F48 N2 P2 -","2","1","","Navarro, Miquel; Miranda-Pizarro, Juan; Moreno, Juan J.; Navarro-Gilabert, Carlos; Fernández, Israel; Campos, Jesús","A dicoordinate gold(I)-ethylene complex.","Chemical communications (Cambridge, England)","2021","57","73","9280","9283","10.1039/d1cc02769g","","","0.71073","MoKα","","0.0783","0.0512","","","0.1414","0.1596","","","","","","1.062","","","","has coordinates,has disorder","269613","2021-10-06","13:46:36",""
"7128784","13.6101","0.0003","51.1209","0.0011","18.3962","0.0004","90","","98.902","0.001","90","","12645.2","0.5","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H79 Au F6 P Sb -","- C62 H79 Au F6 P Sb -","- C496 H632 Au8 F48 P8 Sb8 -","8","2","","Navarro, Miquel; Miranda-Pizarro, Juan; Moreno, Juan J.; Navarro-Gilabert, Carlos; Fernández, Israel; Campos, Jesús","A dicoordinate gold(I)-ethylene complex.","Chemical communications (Cambridge, England)","2021","57","73","9280","9283","10.1039/d1cc02769g","","","0.71073","MoKα","","0.0554","0.0491","","","0.1215","0.1248","","","","","","1.113","","","","has coordinates","269613","2021-10-06","13:46:36",""
"7128785","10.5457","0.0003","10.9949","0.0003","14.6439","0.0004","98.025","0.003","95.841","0.002","115.1","0.003","1497.81","0.08","150","0.1","150","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C30 H31 As B N7 O2 W -","- C30 H31 As B N7 O2 W -","- C60 H62 As2 B2 N14 O4 W2 -","2","1","","Frogley, Benjamin J.; Hill, Anthony F.; Kirk, Ryan M.","Heterocyclic arsinocarbynes via tandem transmetallation.","Chemical communications (Cambridge, England)","2021","57","70","8770","8773","10.1039/d1cc03015a","","x-ray","1.54184","CuKα","","0.0265","0.0261","","","0.0699","0.0703","","","","","","1.06","","","","has coordinates","268503","2021-09-06","09:00:38",""
"7128786","11.65","0.0003","6.7526","0.0002","14.8906","0.0004","90","","102.826","0.002","90","","1142.18","0.06","150.01","0.1","150.01","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 As N -","- C14 H10 As N -","- C56 H40 As4 N4 -","4","1","","Frogley, Benjamin J.; Hill, Anthony F.; Kirk, Ryan M.","Heterocyclic arsinocarbynes via tandem transmetallation.","Chemical communications (Cambridge, England)","2021","57","70","8770","8773","10.1039/d1cc03015a","","x-ray","1.54184","CuKα","","0.032","0.0272","","","0.0661","0.0695","","","","","","1.066","","","","has coordinates","268503","2021-09-06","09:00:51",""
"7128787","41.967","0.008","10.063","0.002","28.004","0.006","90","","130.88","0.03","90","","8942","5","100","0.2","100","0.2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C49 H49 As B N6 O2 W -","- C49 H49 As B N6 O2 W -","- C392 H392 As8 B8 N48 O16 W8 -","8","1","","Frogley, Benjamin J.; Hill, Anthony F.; Kirk, Ryan M.","Heterocyclic arsinocarbynes via tandem transmetallation.","Chemical communications (Cambridge, England)","2021","57","70","8770","8773","10.1039/d1cc03015a","","","0.710762","Synchrotron","","0.0794","0.0552","","","0.1397","0.1571","","","","","","0.994","","","","has coordinates","268503","2021-09-06","09:01:05",""
"7128788","19.0571","0.0002","6.0872","0.0001","20.2253","0.0002","90","","110.451","0.001","90","","2198.34","0.05","150.01","0.1","150.01","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H21 As -","- C30 H21 As -","- C120 H84 As4 -","4","1","","Frogley, Benjamin J.; Hill, Anthony F.; Kirk, Ryan M.","Heterocyclic arsinocarbynes via tandem transmetallation.","Chemical communications (Cambridge, England)","2021","57","70","8770","8773","10.1039/d1cc03015a","","x-ray","1.54184","CuKα","","0.0361","0.0338","","","0.0873","0.0895","","","","","","1.024","","","","has coordinates","268503","2021-09-06","09:01:53",""
"7128789","18.1315","0.0007","21.8847","0.0008","25.2702","0.001","95.683","0.001","101.87","0.001","101.275","0.001","9521.7","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C153 H138 Cl15 Eu3 N12 O18 -","- C153 H138 Cl15 Eu3 N12 O18 -","- C306 H276 Cl30 Eu6 N24 O36 -","2","1","","Chang, Fei-Fan; Feng, Fan-da; Geng, Jiao; Huang, Wei","Self-assembly and luminescence of trinuclear lanthanide based supramolecular circular helicates.","Chemical communications (Cambridge, England)","2021","57","73","9220","9223","10.1039/d1cc03376j","","","0.71073","MoKα","","0.0891","0.0626","","","0.1698","0.1811","","","","","","1.107","","","","has coordinates","269605","2021-10-06","13:43:10",""
"7128790","18.1226","0.0011","30.5452","0.0019","30.1797","0.0018","90","","90.089","0.001","90","","16706.2","1.8","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C153 H136 Cl17 Dy3 N12 O18 -","- C153 H136 Cl17 Dy3 N12 O18 -","- C612 H544 Cl68 Dy12 N48 O72 -","4","0.5","","Chang, Fei-Fan; Feng, Fan-da; Geng, Jiao; Huang, Wei","Self-assembly and luminescence of trinuclear lanthanide based supramolecular circular helicates.","Chemical communications (Cambridge, England)","2021","57","73","9220","9223","10.1039/d1cc03376j","","","0.71073","MoKα","","0.1259","0.071","","","0.172","0.1943","","","","","","1.018","","","","has coordinates","269605","2021-10-06","13:43:11",""
"7128791","18.542","0.005","30.471","0.009","29.708","0.008","90","","90.151","0.007","90","","16785","8","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C153 H136 Cl17 Er3 N12 O18 -","- C153 H136 Cl17 Er3 N12 O18 -","- C612 H544 Cl68 Er12 N48 O72 -","4","0.5","","Chang, Fei-Fan; Feng, Fan-da; Geng, Jiao; Huang, Wei","Self-assembly and luminescence of trinuclear lanthanide based supramolecular circular helicates.","Chemical communications (Cambridge, England)","2021","57","73","9220","9223","10.1039/d1cc03376j","","","0.71073","MoKα","","0.0831","0.06","","","0.1538","0.1637","","","","","","1.074","","","","has coordinates","269605","2021-10-06","13:43:11",""
"7128792","5.0867","0.0002","11.7982","0.0004","5.4598","0.0002","90","","111.983","0.005","90","","303.84","0.02","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H5 N O2 -","- C2 H5 N O2 -","- C8 H20 N4 O8 -","4","1","","Hoser, Anna A.; Sztylko, Marcin; Trzybiński, Damian; Madsen, Anders Ø","Theoretically derived thermodynamic properties can be improved by the refinement of low-frequency modes against X-ray diffraction data.","Chemical communications (Cambridge, England)","2021","57","74","9370","9373","10.1039/d1cc02608a","","x-ray","0.71073","MoKα","","0.0386","0.0317","","","0.0779","0.0841","","","","","","1.078","","","","has coordinates","269652","2021-10-06","13:58:59",""
"7128793","5.0757","0.0002","6.1737","0.0002","5.3882","0.0002","90","","113.422","0.004","90","","154.931","0.011","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C2 H5 N O2 -","- C2 H5 N O2 -","- C4 H10 N2 O4 -","2","1","","Hoser, Anna A.; Sztylko, Marcin; Trzybiński, Damian; Madsen, Anders Ø","Theoretically derived thermodynamic properties can be improved by the refinement of low-frequency modes against X-ray diffraction data.","Chemical communications (Cambridge, England)","2021","57","74","9370","9373","10.1039/d1cc02608a","","x-ray","0.71073","MoKα","","0.0233","0.0229","","","0.0638","0.0642","","","","","","1.1","","","","has coordinates","269652","2021-10-06","13:59:00",""
"7128794","16.0819","0.0006","25.9667","0.0008","17.0515","0.0006","90","","117.912","0.002","90","","6292.2","0.4","170","2","170","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C126 H113 N8 O12 -","- C126 H113 N8 O12 -","- C252 H226 N16 O24 -","2","1","","Ramakrishna, E.; Tang, Jia-Dong; Tao, Jia-Ju; Fang, Qiang; Zhang, Zibin; Huang, Jianying; Li, Shijun","Self-assembly of chiral BINOL cages <i>via</i> imine condensation.","Chemical communications (Cambridge, England)","2021","57","72","9088","9091","10.1039/d1cc01507a","","","1.54178","CuKα","","0.0657","0.0582","","","0.1648","0.1723","","","","","","1.037","","","","has coordinates,has disorder","269665","2021-10-06","14:03:46",""
"7128795","11.39679","0.00013","46.8821","0.0005","16.9513","0.0002","90","","94.0073","0.0011","90","","9035.03","0.18","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Dy(OAd*)2Cl2]","","- C96 H154 Cl2 Dy Na O11 -","- C96 H154 Cl2 Dy Na O11 -","- C384 H616 Cl8 Dy4 Na4 O44 -","4","1","","Parmar, Vijay S.; Gransbury, Gemma K.; Whitehead, George F. S.; Mills, David P.; Winpenny, Richard E. P.","Slow magnetic relaxation in distorted tetrahedral Dy(III) aryloxide complexes.","Chemical communications (Cambridge, England)","2021","57","73","9208","9211","10.1039/d1cc02707g","","x-ray","1.54184","CuKα","","0.0578","0.0463","","","0.1267","0.1354","","","","","","1.046","","","","has coordinates,has disorder","269611","2021-10-06","13:45:13",""
"7128796","15.7711","0.0013","19.5922","0.0014","28.944","0.002","90","","92.064","0.008","90","","8937.6","1.2","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C86 H151 Cl Dy Na O11 -","- C86 H151 Cl Dy Na O11 -","- C344 H604 Cl4 Dy4 Na4 O44 -","4","1","","Parmar, Vijay S.; Gransbury, Gemma K.; Whitehead, George F. S.; Mills, David P.; Winpenny, Richard E. P.","Slow magnetic relaxation in distorted tetrahedral Dy(III) aryloxide complexes.","Chemical communications (Cambridge, England)","2021","57","73","9208","9211","10.1039/d1cc02707g","","x-ray","1.54184","CuKα","","0.1088","0.0652","","","0.1471","0.1738","","","","","","1.027","","","","has coordinates,has disorder","269611","2021-10-06","13:45:14",""
"7128797","11.3031","0.0004","46.2765","0.0015","16.8926","0.0007","90","","94.26","0.004","90","","8811.6","0.6","100","0.1","100","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Y(OAr)2Cl2][Na(THF)6].3THF","","- C96 H154 Cl2 Na O11 Y -","- C96 H154 Cl2 Na O11 Y -","- C384 H616 Cl8 Na4 O44 Y4 -","4","1","","Parmar, Vijay S.; Gransbury, Gemma K.; Whitehead, George F. S.; Mills, David P.; Winpenny, Richard E. P.","Slow magnetic relaxation in distorted tetrahedral Dy(III) aryloxide complexes.","Chemical communications (Cambridge, England)","2021","57","73","9208","9211","10.1039/d1cc02707g","","x-ray","0.71073","MoKα","","0.1349","0.0874","","","0.184","0.1998","","","","","","1.099","","","","has coordinates,has disorder","269611","2021-10-06","13:45:14",""
"7128798","15.72802","0.00017","19.6357","0.0002","28.9797","0.0003","90","","92.6173","0.001","90","","8940.48","0.16","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Dy(OMes*)3(BH4)][Na(THF)6]","","- C86 H155 B Dy Na O11 -","- C86 H155 B Dy Na O11 -","- C344 H620 B4 Dy4 Na4 O44 -","4","1","","Parmar, Vijay S.; Gransbury, Gemma K.; Whitehead, George F. S.; Mills, David P.; Winpenny, Richard E. P.","Slow magnetic relaxation in distorted tetrahedral Dy(III) aryloxide complexes.","Chemical communications (Cambridge, England)","2021","57","73","9208","9211","10.1039/d1cc02707g","","x-ray","1.54184","CuKα","","0.0606","0.0472","","","0.1212","0.1286","","","","","","1.053","","","","has coordinates,has disorder","269611","2021-10-06","13:45:14",""
"7128799","12.5443","0.0006","7.1138","0.0004","10.9392","0.0007","90","","90","","90","","976.19","0.1","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C10 H9 B F2 O2 -","- C10 H9 B F2 O2 -","- C40 H36 B4 F8 O8 -","4","0.5","","Li, Junbo; Wang, Xuepu; Pan, Yingtong; Sun, Yan; Wang, Guangming; Zhang, Kaka","Unexpected long room-temperature phosphorescence lifetimes of up to 1.0 s observed in iodinated molecular systems.","Chemical communications (Cambridge, England)","2021","57","70","8794","8797","10.1039/d1cc04094d","","","0.71073","MoKα","","0.0471","0.0384","","","0.1064","0.1162","","","","","","1.069","","","","has coordinates","268504","2021-09-06","09:02:19",""
"7128800","7.6012","0.0003","14.2747","0.0005","10.6115","0.0004","90","","91.801","0.001","90","","1150.83","0.07","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H8 B F2 I O2 -","- C10 H8 B F2 I O2 -","- C40 H32 B4 F8 I4 O8 -","4","1","","Li, Junbo; Wang, Xuepu; Pan, Yingtong; Sun, Yan; Wang, Guangming; Zhang, Kaka","Unexpected long room-temperature phosphorescence lifetimes of up to 1.0 s observed in iodinated molecular systems.","Chemical communications (Cambridge, England)","2021","57","70","8794","8797","10.1039/d1cc04094d","","","0.71073","MoKα","","0.0318","0.0296","","","0.078","0.0798","","","","","","1.071","","","","has coordinates","268504","2021-09-06","09:02:22",""
"7128801","9.1578","0.0009","21.5786","0.0017","13.1159","0.0012","90","","91.515","0.003","90","","2591","0.4","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C61 H51 Cl2 N -","- C61 H51 Cl2 N -","- C122 H102 Cl4 N2 -","2","1","","Yu, Qian; Zhang, Li; He, Yuhao; Pan, Jinjing; Li, Hao; Bian, Guo-Qing; Chen, Xiaodan; Tan, Gengwen","A stable tetrazagallole and its radical anion dimer.","Chemical communications (Cambridge, England)","2021","57","73","9268","9271","10.1039/d1cc03448k","","","0.71073","MoKα","","0.101","0.0546","","","0.1232","0.1563","","","","","","1.07","","","","has coordinates","269612","2021-10-06","13:45:47",""
"7128802","9.1948","0.0007","21.649","0.0015","13.2822","0.0009","90","","90.634","0.003","90","","2643.8","0.3","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C68 H64 Ga N O2 -","- C68 H64 Ga N O2 -","- C136 H128 Ga2 N2 O4 -","2","1","","Yu, Qian; Zhang, Li; He, Yuhao; Pan, Jinjing; Li, Hao; Bian, Guo-Qing; Chen, Xiaodan; Tan, Gengwen","A stable tetrazagallole and its radical anion dimer.","Chemical communications (Cambridge, England)","2021","57","73","9268","9271","10.1039/d1cc03448k","","","1.34139","GaKα","","0.122","0.0986","","","0.2755","0.2898","","","","","","1.073","","","","has coordinates,has disorder","269612","2021-10-06","13:45:48",""
"7128803","14.3228","0.0012","14.5543","0.0011","14.879","0.0011","66.692","0.002","66.937","0.002","74.731","0.002","2599.2","0.4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H64 K N O2 -","- C68 H64 K N O2 -","- C136 H128 K2 N2 O4 -","2","1","","Yu, Qian; Zhang, Li; He, Yuhao; Pan, Jinjing; Li, Hao; Bian, Guo-Qing; Chen, Xiaodan; Tan, Gengwen","A stable tetrazagallole and its radical anion dimer.","Chemical communications (Cambridge, England)","2021","57","73","9268","9271","10.1039/d1cc03448k","","","0.71073","MoKα","","0.0739","0.0453","","","0.1194","0.1329","","","","","","1.104","","","","has coordinates","269612","2021-10-06","13:45:48",""
"7128804","17.3847","0.0005","17.2277","0.0005","33.7309","0.0011","90","","94.097","0.002","90","","10076.5","0.5","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C92 H98 Ga K N5 O6 -","- C92 H98 Ga K N5 O6 -","- C368 H392 Ga4 K4 N20 O24 -","4","1","","Yu, Qian; Zhang, Li; He, Yuhao; Pan, Jinjing; Li, Hao; Bian, Guo-Qing; Chen, Xiaodan; Tan, Gengwen","A stable tetrazagallole and its radical anion dimer.","Chemical communications (Cambridge, England)","2021","57","73","9268","9271","10.1039/d1cc03448k","","","1.34139","GaKα","","0.1473","0.0782","","","0.1984","0.2441","","","","","","1.039","","","","has coordinates,has disorder","269612","2021-10-06","13:45:48",""
"7128805","13.7438","0.0009","46.807","0.003","22.5165","0.0013","90","","102.572","0.003","90","","14137.7","1.5","135","2","135","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C80 H74 Ga N5 -","- C80 H74 Ga N5 -","- C640 H592 Ga8 N40 -","8","2","","Yu, Qian; Zhang, Li; He, Yuhao; Pan, Jinjing; Li, Hao; Bian, Guo-Qing; Chen, Xiaodan; Tan, Gengwen","A stable tetrazagallole and its radical anion dimer.","Chemical communications (Cambridge, England)","2021","57","73","9268","9271","10.1039/d1cc03448k","","","1.34139","GaKα","","0.0774","0.0489","","","0.1274","0.1421","","","","","","1.034","","","","has coordinates,has disorder","269612","2021-10-06","13:45:48",""
"7128806","10.2902","0.0003","13.8257","0.0004","18.5139","0.0006","90","","90","","90","","2633.96","0.14","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H32 N2 O8 -","- C26 H32 N2 O8 -","- C104 H128 N8 O32 -","4","1","","Wang, Kaixuan; Xu, Chaoran; Hu, Xinyue; Zhou, Yuqiao; Lin, Lili; Feng, Xiaoming","Catalytic asymmetric [3+2] cycloaddition of isomünchnones with methyleneindolinones","Chemical Communications","2021","57","71","8917","8920","10.1039/D1CC03685H","","","1.54178","CuKα","","0.0278","0.0277","","","0.0735","0.0736","","","","","","1.081","","","","has coordinates","269662","2021-10-06","14:02:06",""
"7128807","9.7907","0.0005","11.0235","0.0006","14.4145","0.0008","90","","107.747","0.002","90","","1481.69","0.14","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H42 N2 O9 -","- C29 H42 N2 O9 -","- C58 H84 N4 O18 -","2","1","","Wang, Kaixuan; Xu, Chaoran; Hu, Xinyue; Zhou, Yuqiao; Lin, Lili; Feng, Xiaoming","Catalytic asymmetric [3+2] cycloaddition of isomünchnones with methyleneindolinones","Chemical Communications","2021","57","71","8917","8920","10.1039/D1CC03685H","","","1.54178","CuKα","","0.0315","0.0311","","","0.0801","0.0807","","","","","","1.079","","","","has coordinates,has disorder","269662","2021-10-06","14:02:06",""
"7128808","9.2997","0.0012","17.268","0.002","12.0322","0.0015","90","","92.223","0.002","90","","1930.8","0.4","200","2","200","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H17 Br2 N2 P Zn -","- C18 H17 Br2 N2 P Zn -","- C72 H68 Br8 N8 P4 Zn4 -","4","2","","Berro, Patrick; Norouziyanlakvan, Somayeh; Rao, Gyaneshwar Kumar; Gabidullin, Bulat; Richeson, Darrin","Electrocatalytic reduction of CO<sub>2</sub> to CO and HCO<sub>2</sub><sup>-</sup> with Zn(II) complexes displaying cooperative ligand reduction.","Chemical communications (Cambridge, England)","2021","57","73","9292","9295","10.1039/d1cc03887g","","","0.71073","MoKα","","0.0478","0.0302","","","0.0583","0.0633","","","","","","0.903","","","","has coordinates","269608","2021-10-06","13:44:04",""
"7128809","10.6902","0.0002","10.6902","0.0002","46.4469","0.0009","90","","90","","120","","4596.84","0.15","200","2","200","2","","","","","","","","6","P 61","P 61","169","","","","- C31 H29 Br2 N3 P2 Zn -","- C31 H29 Br2 N3 P2 Zn -","- C186 H174 Br12 N18 P12 Zn6 -","6","1","","Berro, Patrick; Norouziyanlakvan, Somayeh; Rao, Gyaneshwar Kumar; Gabidullin, Bulat; Richeson, Darrin","Electrocatalytic reduction of CO<sub>2</sub> to CO and HCO<sub>2</sub><sup>-</sup> with Zn(II) complexes displaying cooperative ligand reduction.","Chemical communications (Cambridge, England)","2021","57","73","9292","9295","10.1039/d1cc03887g","","","0.71073","MoKα","","0.0467","0.0421","","","0.1026","0.1047","","","","","","1.021","","","","has coordinates","269608","2021-10-06","13:44:08",""
"7128810","19.2591","0.0011","20.1329","0.0012","23.489","0.0009","95.215","0.004","112.055","0.004","113.282","0.006","7441.2","0.9","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C280 H316 Au4 Cl60 Fe2 P8 -","- C252 H260 Au4 Cl4 Fe2 P8 -","- C252 H260 Au4 Cl4 Fe2 P8 -","1","0.5","","Hoy, Reinhard; Grell, Toni; Lönnecke, Peter; Hey-Hawkins, Evamarie","Selective formation of a supramolecular coordination complex in the nanometre scale with a ferrocene-based phospholane ligand","Chemical Communications","2021","57","73","9200","9203","10.1039/D1CC03755B","","","0.71073","MoKα","","0.1193","0.0554","","","0.1156","0.1373","","","","","","0.976","","","","has coordinates,has disorder","269610","2021-10-06","13:44:29",""
"7128811","8.3826","0.0015","12.595","0.002","17.554","0.003","90","","95.527","0.016","90","","1844.7","0.5","298","0.02","298","0.02","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H18 O2 -","- C26 H18 O2 -","- C104 H72 O8 -","4","1","","Mondal, Atanu; Shivangi, ?; Tung, Pinku; Wagulde, Siddhant V.; Ramasastry, S. S. V.","Annulative Morita-Baylis-Hillman reaction to synthesise chiral dibenzocycloheptanes.","Chemical communications (Cambridge, England)","2021","57","73","9260","9263","10.1039/d1cc02765d","","x-ray","0.71073","MoKα","","0.1497","0.0822","","","0.2132","0.2842","","","","","","0.986","","","","has coordinates","269609","2021-10-06","13:44:15",""
"7128812","9.1696","0.0005","10.6774","0.0007","12.2477","0.0007","87.619","0.005","87.821","0.004","72.126","0.005","1139.88","0.12","298","0.2","298","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C29 H26 O2 -","- C29 H26 O2 -","- C58 H52 O4 -","2","1","","Mondal, Atanu; Shivangi, ?; Tung, Pinku; Wagulde, Siddhant V.; Ramasastry, S. S. V.","Annulative Morita-Baylis-Hillman reaction to synthesise chiral dibenzocycloheptanes.","Chemical communications (Cambridge, England)","2021","57","73","9260","9263","10.1039/d1cc02765d","","x-ray","0.71073","MoKα","","0.1208","0.0799","","","0.2234","0.2854","","","","","","1.04","","","","has coordinates","269609","2021-10-06","13:44:16",""
"7128813","12.966","0.003","15.946","0.003","12.986","0.003","90","","117.09","0.03","90","","2390.4","1.1","100","","100","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C50 H78 Al B N2 O3 -","- C50 H78 Al B N2 O3 -","- C100 H156 Al2 B2 N4 O6 -","2","1","","Morris, Louis J.; Carpentier, Ambre; Maron, Laurent; Okuda, Jun","Reductive elimination of [AlH<sub>2</sub>]<sup>+</sup> from a cationic Ga-Al dihydride.","Chemical communications (Cambridge, England)","2021","57","74","9454","9457","10.1039/d1cc03706d","","","1.54178","CuKα","","0.0523","0.0455","","","0.108","0.1104","","","","","","1.005","","","","has coordinates,has disorder","269648","2021-10-06","13:58:02",""
"7128814","12.13","0.002","16.522","0.003","20.716","0.004","96.05","0.03","102.03","0.03","108.2","0.03","3791.9","1.6","150","","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C157 H214 Al4 B2 N12 -","- C157 H214 Al4 B2 N12 -","- C157 H214 Al4 B2 N12 -","1","0.5","","Morris, Louis J.; Carpentier, Ambre; Maron, Laurent; Okuda, Jun","Reductive elimination of [AlH<sub>2</sub>]<sup>+</sup> from a cationic Ga-Al dihydride.","Chemical communications (Cambridge, England)","2021","57","74","9454","9457","10.1039/d1cc03706d","","x-ray","1.54178","CuKα","","0.0668","0.0481","","","0.1304","0.1402","","","","","","0.979","","","","has coordinates,has disorder","269648","2021-10-06","13:58:05",""
"7128815","15.996","0.003","20.151","0.004","19.375","0.004","90","","98.43","0.03","90","","6178","2","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C67 H95 Al B Ga N4 -","- C67 H95 Al B Ga N4 -","- C268 H380 Al4 B4 Ga4 N16 -","4","1","","Morris, Louis J.; Carpentier, Ambre; Maron, Laurent; Okuda, Jun","Reductive elimination of [AlH<sub>2</sub>]<sup>+</sup> from a cationic Ga-Al dihydride.","Chemical communications (Cambridge, England)","2021","57","74","9454","9457","10.1039/d1cc03706d","","","1.54178","CuKα","","0.0419","0.0372","","","0.0965","0.0994","","","","","","1.039","","","","has coordinates","269648","2021-10-06","13:58:06",""
"7128816","16.022","0.003","20.09","0.004","19.443","0.004","90","","98.52","0.03","90","","6189","2","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C67 H95 Al2 B N4 -","- C67 H95 Al2 B N4 -","- C268 H380 Al8 B4 N16 -","4","1","","Morris, Louis J.; Carpentier, Ambre; Maron, Laurent; Okuda, Jun","Reductive elimination of [AlH<sub>2</sub>]<sup>+</sup> from a cationic Ga-Al dihydride.","Chemical communications (Cambridge, England)","2021","57","74","9454","9457","10.1039/d1cc03706d","","","1.54178","CuKα","","0.0433","0.0364","","","0.0936","0.0976","","","","","","1.013","","","","has coordinates","269648","2021-10-06","13:58:06",""
"7128817","16.068","0.003","12.667","0.003","22.56","0.005","90","","109.03","0.03","90","","4340.8","1.8","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H62 Al B N4 -","- C46 H62 Al B N4 -","- C184 H248 Al4 B4 N16 -","4","1","","Morris, Louis J.; Carpentier, Ambre; Maron, Laurent; Okuda, Jun","Reductive elimination of [AlH<sub>2</sub>]<sup>+</sup> from a cationic Ga-Al dihydride.","Chemical communications (Cambridge, England)","2021","57","74","9454","9457","10.1039/d1cc03706d","","x-ray","1.54178","CuKα","","0.0605","0.038","","","0.0959","0.1033","","","","","","0.972","","","","has coordinates","269648","2021-10-06","13:58:06",""
"7128818","15.0103","0.0004","12.9385","0.0003","15.5389","0.0005","90","","111.104","0.001","90","","2815.41","0.14","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H34 N4 O5 -","- C33 H34 N4 O5 -","- C132 H136 N16 O20 -","4","1","","Wang, Chunqin; Han, Songyan; Wang, Tianbao; Zheng, Xuesong; Zhou, Linsen; Liu, Yanhong; Zhang, Cheng; Gao, Ge","Red fluorescent zwitterionic naphthalenediimides with di/mono-benzimidazolium and a negatively-charged oxygen substituent.","Chemical communications (Cambridge, England)","2021","57","74","9422","9425","10.1039/d1cc03586j","","","0.71073","MoKα","","0.0911","0.0512","","","0.1204","0.1383","","","","","","1.04","","","","has coordinates,has disorder","269650","2021-10-06","13:58:35",""
"7128819","11.194","0.005","12.288","0.003","18.063","0.006","90","","95.088","0.014","90","","2474.8","1.5","150","2","149.99","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Br N3 O7 -","- C26 H26 Br N3 O7 -","- C104 H104 Br4 N12 O28 -","4","1","","Cui, Zhaohui; Zhang, Kuan; Gu, Lijie; Bu, Zhanwei; Zhao, Junwei; Wang, Qilin","Diastereoselective trifunctionalization of pyridinium salts to access structurally crowded azaheteropolycycles.","Chemical communications (Cambridge, England)","2021","57","74","9402","9405","10.1039/d1cc03478b","","","0.71073","MoKα","","0.0356","0.0263","","","0.0566","0.0603","","","","","","1.028","","","","has coordinates","269651","2021-10-06","13:58:46",""
"7128820","8.069","0.0002","11.2404","0.0003","27.7333","0.0008","90","","93.281","0.001","90","","2511.25","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H29 N3 O8 -","- C27 H29 N3 O8 -","- C108 H116 N12 O32 -","4","1","","Cui, Zhaohui; Zhang, Kuan; Gu, Lijie; Bu, Zhanwei; Zhao, Junwei; Wang, Qilin","Diastereoselective trifunctionalization of pyridinium salts to access structurally crowded azaheteropolycycles.","Chemical communications (Cambridge, England)","2021","57","74","9402","9405","10.1039/d1cc03478b","","","1.54178","CuKα","","0.0696","0.0535","","","0.1257","0.1361","","","","","","1.033","","","","has coordinates","269651","2021-10-06","13:58:49",""
"7128821","8.9528","0.0003","12.4499","0.0005","26.0558","0.0012","90","","90","","90","","2904.2","0.2","149.99","0.1","149.99","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C31 H26 Cl3 N3 O6 -","- C31 H26 Cl3 N3 O6 -","- C124 H104 Cl12 N12 O24 -","4","1","","Cui, Zhaohui; Zhang, Kuan; Gu, Lijie; Bu, Zhanwei; Zhao, Junwei; Wang, Qilin","Diastereoselective trifunctionalization of pyridinium salts to access structurally crowded azaheteropolycycles.","Chemical communications (Cambridge, England)","2021","57","74","9402","9405","10.1039/d1cc03478b","","x-ray","1.54184","CuKα","","0.0721","0.0624","","","0.1571","0.1694","","","","","","1.05","","","","has coordinates,has disorder","269651","2021-10-06","13:58:52",""
"7128822","8.9802","0.0005","12.365","0.0006","12.6363","0.0006","109.475","0.004","94.551","0.004","90.087","0.004","1318.1","0.12","150","0.1","150","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C30 H29 N3 O7 -","- C30 H29 N3 O7 -","- C60 H58 N6 O14 -","2","1","","Cui, Zhaohui; Zhang, Kuan; Gu, Lijie; Bu, Zhanwei; Zhao, Junwei; Wang, Qilin","Diastereoselective trifunctionalization of pyridinium salts to access structurally crowded azaheteropolycycles.","Chemical communications (Cambridge, England)","2021","57","74","9402","9405","10.1039/d1cc03478b","","x-ray","0.71073","MoKα","","0.0561","0.0414","","","0.0938","0.1039","","","","","","1.03","","","","has coordinates,has disorder","269651","2021-10-06","13:58:52",""
"7128823","17.5346","0.0002","13.3406","0.0002","23.6839","0.0003","90","","98.365","0.001","90","","5481.25","0.13","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C64 H76 Mg2 N4 -","- C64 H76 Mg2 N4 -","- C256 H304 Mg8 N16 -","4","1","","Yuvaraj, K.; Jones, Cameron","Reductive coupling of CO with magnesium anthracene complexes: formation of magnesium enediolates.","Chemical communications (Cambridge, England)","2021","57","73","9224","9227","10.1039/d1cc03890g","","","1.54184","CuKα","","0.0424","0.0395","","","0.1048","0.1072","","","","","","1.042","","","","has coordinates","269618","2021-10-06","13:48:05",""
"7128824","21.3094","0.0002","14.5347","0.0002","26.9566","0.0003","90","","100.011","0.001","90","","8222.03","0.17","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C94 H108 Mg4 O12.5 -","- C84 H88 Mg4 O10 -","- C336 H352 Mg16 O40 -","4","1","","Yuvaraj, K.; Jones, Cameron","Reductive coupling of CO with magnesium anthracene complexes: formation of magnesium enediolates.","Chemical communications (Cambridge, England)","2021","57","73","9224","9227","10.1039/d1cc03890g","","","1.54184","CuKα","","0.0599","0.0467","","","0.1148","0.121","","","","","","1.043","","","","has coordinates,has disorder","269618","2021-10-06","13:48:05",""
"7128825","33.1446","0.0007","18.8553","0.0003","23.5022","0.0005","90","","109.114","0.002","90","","13878","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C321 H412 Mg8 N16 O8 -","- C264 H304 Mg8 N16 O8 -","- C528 H608 Mg16 N32 O16 -","2","0.5","","Yuvaraj, K.; Jones, Cameron","Reductive coupling of CO with magnesium anthracene complexes: formation of magnesium enediolates.","Chemical communications (Cambridge, England)","2021","57","73","9224","9227","10.1039/d1cc03890g","","","1.54184","CuKα","","0.1262","0.0756","","","0.162","0.1832","","","","","","1.022","","","","has coordinates,has disorder","269618","2021-10-06","13:48:05",""
"7128826","13.301","0.003","19.539","0.004","25.912","0.005","88.26","0.03","86.73","0.03","83.85","0.03","6683","2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C145 H160 Mg4 N8 O4 -","- C131 H144 Mg4 N8 O4 -","- C262 H288 Mg8 N16 O8 -","2","1","","Yuvaraj, K.; Jones, Cameron","Reductive coupling of CO with magnesium anthracene complexes: formation of magnesium enediolates.","Chemical communications (Cambridge, England)","2021","57","73","9224","9227","10.1039/d1cc03890g","","","0.7109","Synchrotron","","0.0912","0.0788","","","0.235","0.2456","","","","","","1.081","","","","has coordinates","269618","2021-10-06","13:48:05",""
"7128827","7.2166","0.0006","13.8579","0.0014","21.181","0.002","79.132","0.006","84.396","0.005","86.572","0.005","2068.5","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H28 I2 N3 O P Ru -","- C16 H28 I2 N3 O P Ru -","- C64 H112 I8 N12 O4 P4 Ru4 -","4","2","","Trivedi, Manoj; Sharma, Pooja; Pandey, Indresh Kumar; Kumar, Abhinav; Kumar, Sanjay; Rath, Nigam P.","Acid-assisted hydrogenation of CO<sub>2</sub> to methanol using Ru(II) and Rh(III) RAPTA-type catalysts under mild conditions.","Chemical communications (Cambridge, England)","2021","57","71","8941","8944","10.1039/d1cc03049c","","","0.71073","MoKα","","0.0468","0.0311","","","0.0578","0.0631","","","","","","1.019","","","","has coordinates","269658","2021-10-06","14:00:54",""
"7128828","5.9954","0.0002","10.0675","0.0004","16.2734","0.0007","100.637","0.0019","95.0698","0.0019","103.261","0.0019","930.81","0.06","296","2","296.15","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H17 F3 O3 S -","- C21 H17 F3 O3 S -","- C42 H34 F6 O6 S2 -","2","1","","Ye, Zhi-Peng; Gao, Jie; Duan, Xin-Yu; Guan, Jian-Ping; Liu, Fang; Chen, Kai; Xiao, Jun-An; Xiang, Hao-Yue; Yang, Hua","Electrochemical heterodifunctionalization of α-CF<sub>3</sub> alkenes to access α-trifluoromethyl-β-sulfonyl tertiary alcohols.","Chemical communications (Cambridge, England)","2021","57","71","8969","8972","10.1039/d1cc03288g","","","0.71073","MoKα","","0.0496","0.0431","","","0.1154","0.1215","","","","","","1.047","","","","has coordinates","298703","2025-04-03","05:34:20",""
"7128832","7.0141","0.0007","11.039","0.0011","22.18","0.002","90","","97.678","0.003","90","","1702","0.3","301","2","301","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","ORGANIC","","","- C18 H20 N2 O3 -","- C18 H20 N2 O3 -","- C72 H80 N8 O12 -","4","1","","Sarkar, Souvik; Sahoo, Tapan; Sen, Chiranjit; Ghosh, Subhash Chandra","Copper(II) mediated <i>ortho</i> C-H alkoxylation of aromatic amines using organic peroxides: efficient synthesis of hindered ethers.","Chemical communications (Cambridge, England)","2021","57","71","8949","8952","10.1039/d1cc01803e","","","0.71073","MoKα","","0.1973","0.0866","","","0.2518","0.3669","","","","","","0.966","","","","has coordinates","269659","2021-10-06","14:01:02",""
"7128833","10.9309","0.0002","25.9004","0.0005","17.5286","0.0003","90","","102.9","0.003","90","","4837.35","0.16","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41.5 H50 B20 F6 S2 -","- C41.5 H50 B20 F6 S2 -","- C166 H200 B80 F24 S8 -","4","1","","Li, Chong; Aldred, Matthew P.; Harder, Rachel A.; Chen, Ying; Yufit, Dmitry S.; Zhu, Ming-Qiang; Fox, Mark A.","Carborane photochromism: a fatigue resistant carborane switch.","Chemical communications (Cambridge, England)","2021","57","74","9466","9469","10.1039/d1cc03248h","","x-ray","0.71073","MoKα","","0.0866","0.0633","","","0.1466","0.1613","","","","","","1.017","","","","has coordinates,has disorder","269649","2021-10-06","13:58:16",""
"7128834","10.7814","0.0002","14.0893","0.0003","18.4393","0.0004","100.45","0.002","101.146","0.0019","101.436","0.0019","2622.34","0.1","120","","120","","","","","","","","","4","P -1","-P 1","2","","","","- C31 H18 F6 S2 -","- C31 H18 F6 S2 -","- C124 H72 F24 S8 -","4","2","","Li, Chong; Aldred, Matthew P.; Harder, Rachel A.; Chen, Ying; Yufit, Dmitry S.; Zhu, Ming-Qiang; Fox, Mark A.","Carborane photochromism: a fatigue resistant carborane switch.","Chemical communications (Cambridge, England)","2021","57","74","9466","9469","10.1039/d1cc03248h","","","0.71073","MoKα","","0.0813","0.0612","","","0.1418","0.1554","","","","","","1.043","","","","has coordinates,has disorder","269649","2021-10-06","13:58:16",""
"7128835","8.3313","0.0017","8.8068","0.0015","10.2625","0.0015","77.537","0.014","72.055","0.016","75.3","0.016","685.1","0.2","149.99","0.1","149.99","0.1","","","","","","","","3","P -1","-P 1","2","","","","- C18 H18 O2 -","- C18 H18 O2 -","- C36 H36 O4 -","2","1","","Chen, Fangyuan; Tang, Junyuan; Wei, Yinhui; Tian, Jingyuan; Gao, Hui; Yi, Wei; Zhou, Zhi","Rh(III)-Catalyzed and synergistic dual directing group-enabled redox-neutral [3+3] annulation of <i>N</i>-phenoxyacetamides with α-allenols.","Chemical communications (Cambridge, England)","2021","57","73","9284","9287","10.1039/d1cc03206b","","x-ray","0.71073","MoKα","","0.1104","0.0832","","","0.2123","0.2471","","","","","","0.998","","","","has coordinates","269614","2021-10-06","13:46:45",""
"7128836","13.63748","0.00012","16.05559","0.00014","13.67121","0.00012","90","","90.1859","0.0008","90","","2993.4","0.05","173.01","0.1","173.01","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H32 O4 Zn4 -","- C28 H32 O4 Zn4 -","- C112 H128 O16 Zn16 -","4","1","","Borys, Andryj M.; Gil-Negrete, Jose M; Hevia, Eva","Atom-efficient transition-metal-free arylation of <i>N</i>,<i>O</i>-acetals using diarylzinc reagents through Zn/Zn cooperativity.","Chemical communications (Cambridge, England)","2021","57","71","8905","8908","10.1039/d1cc04137a","","x-ray","1.54184","CuKα","","0.0536","0.0525","","","0.1487","0.1493","","","","","","1.094","","","","has coordinates","269660","2021-10-06","14:01:33",""
"7128837","9.4666","0.0004","17.7242","0.0007","16.3037","0.0005","90","","96.154","0.003","90","","2719.8","0.18","173.01","0.1","173.01","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H26 F10 N2 Zn -","- C29 H26 F10 N2 Zn -","- C116 H104 F40 N8 Zn4 -","4","1","","Borys, Andryj M.; Gil-Negrete, Jose M; Hevia, Eva","Atom-efficient transition-metal-free arylation of <i>N</i>,<i>O</i>-acetals using diarylzinc reagents through Zn/Zn cooperativity.","Chemical communications (Cambridge, England)","2021","57","71","8905","8908","10.1039/d1cc04137a","","x-ray","1.54184","CuKα","","0.1983","0.1933","","","0.5125","0.5157","","","","","","2.419","","","","has coordinates","269660","2021-10-06","14:01:36",""
"7128838","10.1787","0.0001","10.3481","0.0002","19.0323","0.0003","85.652","0.001","82.545","0.001","84.931","0.001","1975.75","0.05","173","0.1","173","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C35 H20 F20 O4 Zn4 -","- C35 H20 F20 O4 Zn4 -","- C70 H40 F40 O8 Zn8 -","2","1","","Borys, Andryj M.; Gil-Negrete, Jose M; Hevia, Eva","Atom-efficient transition-metal-free arylation of <i>N</i>,<i>O</i>-acetals using diarylzinc reagents through Zn/Zn cooperativity.","Chemical communications (Cambridge, England)","2021","57","71","8905","8908","10.1039/d1cc04137a","","x-ray","1.54184","CuKα","","0.0308","0.0289","","","0.0791","0.0803","","","","","","1.036","","","","has coordinates","269660","2021-10-06","14:01:39",""
"7128839","12.8055","0.0005","14.5382","0.001","16.1933","0.001","66.616","0.006","75.238","0.004","85.544","0.004","2674.8","0.3","173","0.1","173","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C102 H126 O16 Zn14 -","- C102 H126 O16 Zn14 -","- C102 H126 O16 Zn14 -","1","0.5","","Borys, Andryj M.; Gil-Negrete, Jose M; Hevia, Eva","Atom-efficient transition-metal-free arylation of <i>N</i>,<i>O</i>-acetals using diarylzinc reagents through Zn/Zn cooperativity.","Chemical communications (Cambridge, England)","2021","57","71","8905","8908","10.1039/d1cc04137a","","x-ray","0.71073","MoKα","","0.2263","0.0619","","","0.078","0.0841","","","","","","0.903","","","","has coordinates","269660","2021-10-06","14:01:42",""
"7128840","17.6006","0.0011","9.5335","0.0004","25.8773","0.0017","90","","105.878","0.005","90","","4176.4","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C53 H56 Fe N2 O Si -","- C53 H56 Fe N2 O Si -","- C212 H224 Fe4 N8 O4 Si4 -","4","1","","Weyer, Nadine; Heinz, Myron; Bruhn, Clemens; Holthausen, Max C.; Siemeling, Ulrich","Reactivity of an N-heterocyclic silylene with a 1,1'-ferrocenediyl backbone towards carbonyl compounds, including carbon suboxide.","Chemical communications (Cambridge, England)","2021","57","74","9378","9381","10.1039/d1cc03947d","","","0.71073","MoKα","","0.1741","0.0851","","","0.1469","0.1943","","","","","","1.085","","","","has coordinates","269645","2021-10-06","13:57:21",""
"7128841","15.3738","0.0006","22.1555","0.0006","20.5912","0.0008","90","","95.588","0.003","90","","6980.3","0.4","100","2","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C82 H95 Fe2 N4 O4 Si2 -","- C82 H95 Fe2 N4 O4 Si2 -","- C328 H380 Fe8 N16 O16 Si8 -","4","1","","Weyer, Nadine; Heinz, Myron; Bruhn, Clemens; Holthausen, Max C.; Siemeling, Ulrich","Reactivity of an N-heterocyclic silylene with a 1,1'-ferrocenediyl backbone towards carbonyl compounds, including carbon suboxide.","Chemical communications (Cambridge, England)","2021","57","74","9378","9381","10.1039/d1cc03947d","","x-ray","1.54186","CuKα","","0.1016","0.0727","","","0.1694","0.1914","","","","","","1.031","","","","has coordinates","269645","2021-10-06","13:57:21",""
"7128842","22.7412","0.0009","10.0006","0.0003","23.1761","0.001","90","","114.07","0.003","90","","4812.5","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C106 H112 Fe2 N4 O2 Si2 -","- C106 H112 Fe2 N4 O2 Si2 -","- C212 H224 Fe4 N8 O4 Si4 -","2","0.5","","Weyer, Nadine; Heinz, Myron; Bruhn, Clemens; Holthausen, Max C.; Siemeling, Ulrich","Reactivity of an N-heterocyclic silylene with a 1,1'-ferrocenediyl backbone towards carbonyl compounds, including carbon suboxide.","Chemical communications (Cambridge, England)","2021","57","74","9378","9381","10.1039/d1cc03947d","","x-ray","1.54186","CuKα","","0.0835","0.0549","","","0.1255","0.1391","","","","","","1.032","","","","has coordinates","269645","2021-10-06","13:57:21",""
"7128843","11.3202","0.0007","11.3024","0.0006","16.7461","0.0009","84.184","0.004","70.145","0.005","88.898","0.005","2004.6","0.2","100","2","100.15","","","","","","","","","6","P -1","-P 1","2","","","","- C48 H52 Fe N2 O2 Si -","- C48 H52 Fe N2 O2 Si -","- C96 H104 Fe2 N4 O4 Si2 -","2","1","","Weyer, Nadine; Heinz, Myron; Bruhn, Clemens; Holthausen, Max C.; Siemeling, Ulrich","Reactivity of an N-heterocyclic silylene with a 1,1'-ferrocenediyl backbone towards carbonyl compounds, including carbon suboxide.","Chemical communications (Cambridge, England)","2021","57","74","9378","9381","10.1039/d1cc03947d","","","0.71073","MoKα","","0.0603","0.0494","","","0.1285","0.1362","","","","","","1.026","","","","has coordinates","269645","2021-10-06","13:57:21",""
"7128844","9.9638","0.0005","17.1476","0.0005","12.4864","0.0006","90","","110.84","0.004","90","","1993.8","0.16","100","2","100.15","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C48 H52 Fe N2 O Si -","- C48 H52 Fe N2 O Si -","- C96 H104 Fe2 N4 O2 Si2 -","2","0.5","","Weyer, Nadine; Heinz, Myron; Bruhn, Clemens; Holthausen, Max C.; Siemeling, Ulrich","Reactivity of an N-heterocyclic silylene with a 1,1'-ferrocenediyl backbone towards carbonyl compounds, including carbon suboxide.","Chemical communications (Cambridge, England)","2021","57","74","9378","9381","10.1039/d1cc03947d","","","0.71073","MoKα","","0.0552","0.045","","","0.1113","0.1203","","","","","","1.092","","","","has coordinates","269645","2021-10-06","13:57:21",""
"7128845","15.18","0.003","22.128","0.002","20.694","0.004","90","","96.132","0.014","90","","6911","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C82 H93 Fe2 N4 O3 Si2 -","- C82 H93 Fe2 N4 O3 Si2 -","- C328 H372 Fe8 N16 O12 Si8 -","4","1","","Weyer, Nadine; Heinz, Myron; Bruhn, Clemens; Holthausen, Max C.; Siemeling, Ulrich","Reactivity of an N-heterocyclic silylene with a 1,1'-ferrocenediyl backbone towards carbonyl compounds, including carbon suboxide.","Chemical communications (Cambridge, England)","2021","57","74","9378","9381","10.1039/d1cc03947d","","x-ray","1.54186","CuKα","","0.0854","0.0641","","","0.1554","0.1725","","","","","","1.042","","","","has coordinates","269645","2021-10-06","13:57:21",""
"7128846","35.2084","0.0015","11.2249","0.0004","17.4082","0.0007","90","","107.998","0.003","90","","6543.3","0.5","100","2","100.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C37 H48 Fe N2 O Si -","- C37 H48 Fe N2 O Si -","- C296 H384 Fe8 N16 O8 Si8 -","8","1","","Weyer, Nadine; Heinz, Myron; Bruhn, Clemens; Holthausen, Max C.; Siemeling, Ulrich","Reactivity of an N-heterocyclic silylene with a 1,1'-ferrocenediyl backbone towards carbonyl compounds, including carbon suboxide.","Chemical communications (Cambridge, England)","2021","57","74","9378","9381","10.1039/d1cc03947d","","","0.71073","MoKα","","0.0665","0.0469","","","0.1081","0.1188","","","","","","1.019","","","","has coordinates","269645","2021-10-06","13:57:21",""
"7128847","11.9598","0.0007","12.3574","0.0007","28.0107","0.0015","90","","90","","90","","4139.8","0.4","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C36 H48 F6 N6 Ni O5 S2 -","- C36 H48 F6 N6 Ni O5 S2 -","- C144 H192 F24 N24 Ni4 O20 S8 -","4","1","","Pandey, Pragati; Bera, Jitendra K.","Hydrosilylative reduction of primary amides to primary amines catalyzed by a terminal [Ni-OH] complex.","Chemical communications (Cambridge, England)","2021","57","73","9204","9207","10.1039/d1cc03537a","","","0.71073","MoKα","","0.0708","0.0456","","","0.089","0.0964","","","","","","1.042","","","","has coordinates","269617","2021-10-06","13:47:30",""
"7128848","16.6591","0.001","16.9699","0.001","17.4164","0.0009","90","","90","","90","","4923.7","0.5","100","2","100","2","","","","","","","","8","C 2 2 21","C 2c 2","20","","","","- C19 H26 Cl2 F3 N3 Ni O3 S -","- C19 H26 Cl2 F3 N3 Ni O3 S -","- C152 H208 Cl16 F24 N24 Ni8 O24 S8 -","8","1","","Pandey, Pragati; Bera, Jitendra K.","Hydrosilylative reduction of primary amides to primary amines catalyzed by a terminal [Ni-OH] complex.","Chemical communications (Cambridge, England)","2021","57","73","9204","9207","10.1039/d1cc03537a","","","0.71073","MoKα","","0.0676","0.0453","","","0.0864","0.0932","","","","","","1.004","","","","has coordinates","269617","2021-10-06","13:47:30",""
"7128849","8.7211","0.0009","10.2273","0.0011","13.1114","0.0015","86.861","0.003","89.208","0.003","88.693","0.003","1167.3","0.2","100","2","100","2","","","","","","","","7","P 1","P 1","1","","","","- C23 H28 F3 N3 Ni O3 S -","- C23 H28 F3 N3 Ni O2 S -","- C46 H56 F6 N6 Ni2 O4 S2 -","2","2","","Pandey, Pragati; Bera, Jitendra K.","Hydrosilylative reduction of primary amides to primary amines catalyzed by a terminal [Ni-OH] complex.","Chemical communications (Cambridge, England)","2021","57","73","9204","9207","10.1039/d1cc03537a","","","0.71073","MoKα","","0.0329","0.0311","","","0.0788","0.0811","","","","","","1.026","","","","has coordinates","295359","2024-10-08","18:26:32",""
"7128850","11.504","0.005","15.705","0.006","13.626","0.005","90","","101.704","0.007","90","","2410.6","1.7","100","2","100","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C37 H50 Cl4 F6 N6 Ni O4 S2 -","- C37 H50 Cl4 F6 N6 Ni O4 S2 -","- C74 H100 Cl8 F12 N12 Ni2 O8 S4 -","2","1","","Pandey, Pragati; Bera, Jitendra K.","Hydrosilylative reduction of primary amides to primary amines catalyzed by a terminal [Ni-OH] complex.","Chemical communications (Cambridge, England)","2021","57","73","9204","9207","10.1039/d1cc03537a","","","0.71073","MoKα","","0.0968","0.0498","","","0.0964","0.1238","","","","","","1.034","","","","has coordinates","269617","2021-10-06","13:47:30",""
"7128851","23.6705","0.0011","23.6705","0.0011","16.1646","0.0008","90","","90","","120","","7843.5","0.6","100","2","100","2","","","","","","","","7","P 65","P 65","170","","","","- C36 H47 F6 N9 Ni O5 S2 -","- C36 H47 F6 N9 Ni O4 S2 -","- C216 H282 F36 N54 Ni6 O24 S12 -","6","1","","Pandey, Pragati; Bera, Jitendra K.","Hydrosilylative reduction of primary amides to primary amines catalyzed by a terminal [Ni-OH] complex.","Chemical communications (Cambridge, England)","2021","57","73","9204","9207","10.1039/d1cc03537a","","","0.71073","MoKα","","0.0652","0.0449","","","0.1031","0.1117","","","","","","1.028","","","","has coordinates,has disorder","269617","2021-10-06","13:47:30",""
"7128852","9.5354","0.0003","13.7676","0.0005","15.1853","0.0004","90","","90.373","0.003","90","","1993.48","0.11","113.15","","113.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 N O3 P -","- C22 H24 N O3 P -","- C88 H96 N4 O12 P4 -","4","1","","Huang, Wen-Bin; Qiu, Li-Qi; Ren, Fang-Yu; He, Liang-Nian","Facile synthesis of α-aminophosphine oxides from diarylphosphine oxides, arynes and formamides.","Chemical communications (Cambridge, England)","2021","57","75","9578","9581","10.1039/d1cc04101k","","x-ray","0.71073","MoKα","","0.0517","0.0415","","","0.0991","0.1055","","","","","","1.041","","","","has coordinates","269642","2021-10-06","13:56:25",""
"7128853","9","0.0017","11.736","0.002","14.406","0.003","90","","90.775","0.004","90","","1521.5","0.5","153","","153","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C30 H27 B2 F8 N Pd2 Pt -","- C30 H27 B2 F8 N Pd2 Pt -","- C60 H54 B4 F16 N2 Pd4 Pt2 -","2","1","","Yamaura, Hiroshige; Yamamoto, Koji; Murahashi, Tetsuro","Selective dimerization of a trinuclear mixed-metal sandwich complex: construction of an axially chiral metal skeleton.","Chemical communications (Cambridge, England)","2021","57","72","9120","9123","10.1039/d1cc03719f","","","0.71075","MoKα","","0.1063","0.0879","","","0.2167","0.2451","","","","","","1.13","","","","has coordinates","269666","2021-10-06","14:04:03",""
"7128854","10.2863","0.0003","10.8987","0.0004","17.5682","0.0005","104.171","0.0009","103.203","0.0009","92.3928","0.0011","1849.14","0.1","153","2","153.15","","","","","","","","","7","P -1","-P 1","2","","","","- C42 H36 B2 F8 O Pd Pt2 -","- C42 H36 B2 F8 O Pd Pt2 -","- C84 H72 B4 F16 O2 Pd2 Pt4 -","2","1","","Yamaura, Hiroshige; Yamamoto, Koji; Murahashi, Tetsuro","Selective dimerization of a trinuclear mixed-metal sandwich complex: construction of an axially chiral metal skeleton.","Chemical communications (Cambridge, England)","2021","57","72","9120","9123","10.1039/d1cc03719f","","x-ray","0.71075","MoKα","","0.0545","0.0501","","","0.1493","0.1516","","","","","","1.123","","","","has coordinates","269666","2021-10-06","14:04:04",""
"7128855","11.4221","0.0004","13.8137","0.0004","14.3901","0.0004","83.8592","0.0008","76.9542","0.0009","71.2097","0.0009","2092.56","0.11","143.15","","143.15","","","","","","","","","7","P -1","-P 1","2","","","","- C36 H40 B2 F8 N4 Pd4 Pt2 -","- C36 H40 B2 F8 N4 Pd4 Pt2 -","- C72 H80 B4 F16 N8 Pd8 Pt4 -","2","1","","Yamaura, Hiroshige; Yamamoto, Koji; Murahashi, Tetsuro","Selective dimerization of a trinuclear mixed-metal sandwich complex: construction of an axially chiral metal skeleton.","Chemical communications (Cambridge, England)","2021","57","72","9120","9123","10.1039/d1cc03719f","","x-ray","0.71075","MoKα","","0.0411","0.0388","","","0.0946","0.0961","","","","","","1.021","","","","has coordinates","269666","2021-10-06","14:04:04",""
"7128856","12.7384","0.0003","15.0444","0.0004","16.389","0.0004","89.1192","0.0007","80.0982","0.0007","75.3532","0.0007","2992.18","0.13","123","","123","","","","","","","","","6","P -1","-P 1","2","","","","- C71 H63 B2 F8 Pd2 Pt4 -","- C71 H63 B2 F8 Pd2 Pt4 -","- C142 H126 B4 F16 Pd4 Pt8 -","2","1","","Yamaura, Hiroshige; Yamamoto, Koji; Murahashi, Tetsuro","Selective dimerization of a trinuclear mixed-metal sandwich complex: construction of an axially chiral metal skeleton.","Chemical communications (Cambridge, England)","2021","57","72","9120","9123","10.1039/d1cc03719f","","","0.71075","MoKα","","0.0291","0.0257","","","0.0629","0.0643","","","","","","1.042","","","","has coordinates","269666","2021-10-06","14:04:04",""
"7128857","12.8904","0.0002","7.4881","0.0001","31.9207","0.0004","90","","101.584","0.001","90","","3018.37","0.07","99.99","0.1","99.99","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C44 H36 S -","- C44 H36 S -","- C176 H144 S4 -","4","1","","Agrawal, Abhijeet R.; Kumar, Neha Rani; Choudhury, Aditya; Zade, Sanjio S.","Synthesis of bent-shaped π-extended thienoacenes from 2,5-distannylated 3,4-dialkynethiophene.","Chemical communications (Cambridge, England)","2021","57","75","9538","9541","10.1039/d1cc04283a","","x-ray","1.54184","CuKα","","0.0347","0.0338","","","0.087","0.0875","","","","","","1.065","","","","has coordinates","269641","2021-10-06","13:56:19",""
"7128858","6.0314","0.0003","7.4369","0.0003","23.9241","0.001","90","","92.818","0.002","90","","1071.82","0.08","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C22 H18 Cl3 F N2 O4 -","- C22 H18 Cl3 F N2 O4 -","- C44 H36 Cl6 F2 N4 O8 -","2","1","","Kaur, Kirandeep; Humbrías-Martín, Jorge; Hoppmann, Leon; Fernández-Salas, Jose A; Daniliuc, Constantin G.; Alemán, José; Mancheño, Olga García","Enantioselective vinylogous-Mukaiyama-type dearomatisation by anion-binding catalysis.","Chemical communications (Cambridge, England)","2021","57","73","9244","9247","10.1039/d1cc03514b","","x-ray","0.71073","MoKα","","0.0261","0.0244","","","0.0556","0.0567","","","","","","1.031","","","","has coordinates","269620","2021-10-06","13:48:20",""
"7128859","9.6865","0.0007","10.34","0.0008","17.7546","0.0011","90","","90","","90","","1778.3","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H28 N2 O4 -","- C16 H28 N2 O4 -","- C64 H112 N8 O16 -","4","1","","Mao, Zhuo-Ya; Nie, Xiao-Di; Feng, Yi-Man; Si, Chang-Mei; Wei, Bang-Guo; Lin, Guo-Qiang","Cu(OTf)<sub>2</sub> catalyzed Ugi-type reaction of <i>N</i>,<i>O</i>-acetals with isocyanides for the synthesis of pyrrolidinyl and piperidinyl 2-carboxamides.","Chemical communications (Cambridge, England)","2021","57","73","9248","9251","10.1039/d1cc03113a","","","0.71073","MoKα","","0.0546","0.0389","","","0.0833","0.0935","","","","","","1.039","","","","has coordinates","269606","2021-10-06","13:43:26",""
"7128860","6.0632","0.0003","26.8654","0.0012","10.3001","0.0005","90","","92.299","0.002","90","","1676.44","0.14","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H22 Cl2 N2 O -","- C15 H22 Cl2 N2 O -","- C60 H88 Cl8 N8 O4 -","4","1","","Mao, Zhuo-Ya; Nie, Xiao-Di; Feng, Yi-Man; Si, Chang-Mei; Wei, Bang-Guo; Lin, Guo-Qiang","Cu(OTf)<sub>2</sub> catalyzed Ugi-type reaction of <i>N</i>,<i>O</i>-acetals with isocyanides for the synthesis of pyrrolidinyl and piperidinyl 2-carboxamides.","Chemical communications (Cambridge, England)","2021","57","73","9248","9251","10.1039/d1cc03113a","","","0.71073","MoKα","","0.0703","0.0458","","","0.0894","0.1028","","","","","","1.075","","","","has coordinates","269606","2021-10-06","13:43:26",""
"7128861","6.506","0.0004","4.7861","0.0003","21.3358","0.001","90","","96.991","0.002","90","","659.42","0.07","213","2","213","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C12 H15 Br Cl F N2 O -","- C12 H15 Br Cl F N2 O -","- C24 H30 Br2 Cl2 F2 N4 O2 -","2","1","","Mao, Zhuo-Ya; Nie, Xiao-Di; Feng, Yi-Man; Si, Chang-Mei; Wei, Bang-Guo; Lin, Guo-Qiang","Cu(OTf)<sub>2</sub> catalyzed Ugi-type reaction of <i>N</i>,<i>O</i>-acetals with isocyanides for the synthesis of pyrrolidinyl and piperidinyl 2-carboxamides.","Chemical communications (Cambridge, England)","2021","57","73","9248","9251","10.1039/d1cc03113a","","","0.71073","MoKα","","0.0205","0.0195","","","0.0487","0.049","","","","","","0.998","","","","has coordinates","269606","2021-10-06","13:43:26",""
"7128862","9.8421","0.0019","19.15","0.004","10.45","0.002","90","","90","","90","","1969.6","0.7","192","2","192","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C24 H22 N2 O2 -","- C24 H22 N2 O2 -","- C96 H88 N8 O8 -","4","1","","Mao, Zhuo-Ya; Nie, Xiao-Di; Feng, Yi-Man; Si, Chang-Mei; Wei, Bang-Guo; Lin, Guo-Qiang","Cu(OTf)<sub>2</sub> catalyzed Ugi-type reaction of <i>N</i>,<i>O</i>-acetals with isocyanides for the synthesis of pyrrolidinyl and piperidinyl 2-carboxamides.","Chemical communications (Cambridge, England)","2021","57","73","9248","9251","10.1039/d1cc03113a","","","0.71073","MoKα","","0.0915","0.0544","","","0.0999","0.1203","","","","","","1.094","","","","has coordinates","269606","2021-10-06","13:43:26",""
"7128863","13.468","0.0013","14.2172","0.0013","10.9007","0.001","90","","92.363","0.003","90","","2085.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 N2 O4 -","- C20 H30 N2 O4 -","- C80 H120 N8 O16 -","4","1","","Mao, Zhuo-Ya; Nie, Xiao-Di; Feng, Yi-Man; Si, Chang-Mei; Wei, Bang-Guo; Lin, Guo-Qiang","Cu(OTf)<sub>2</sub> catalyzed Ugi-type reaction of <i>N</i>,<i>O</i>-acetals with isocyanides for the synthesis of pyrrolidinyl and piperidinyl 2-carboxamides.","Chemical communications (Cambridge, England)","2021","57","73","9248","9251","10.1039/d1cc03113a","","","0.71073","MoKα","","0.0908","0.0521","","","0.1082","0.1293","","","","","","1.085","","","","has coordinates","269606","2021-10-06","13:43:26",""
"7128864","9.9031","0.0014","9.9209","0.0015","10.8025","0.0014","72.827","0.004","89.188","0.004","78.782","0.005","993.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H30 N2 O2 -","- C22 H30 N2 O2 -","- C44 H60 N4 O4 -","2","1","","Mao, Zhuo-Ya; Nie, Xiao-Di; Feng, Yi-Man; Si, Chang-Mei; Wei, Bang-Guo; Lin, Guo-Qiang","Cu(OTf)<sub>2</sub> catalyzed Ugi-type reaction of <i>N</i>,<i>O</i>-acetals with isocyanides for the synthesis of pyrrolidinyl and piperidinyl 2-carboxamides.","Chemical communications (Cambridge, England)","2021","57","73","9248","9251","10.1039/d1cc03113a","","","0.71073","MoKα","","0.0787","0.0574","","","0.1469","0.1651","","","","","","1.029","","","","has coordinates","269606","2021-10-06","13:43:26",""
"7128865","8.3317","0.0003","14.2855","0.0005","15.6527","0.0006","90","","100.345","0.0012","90","","1832.74","0.12","","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H36 Cl4 O4 -","- C46 H36 Cl4 O4 -","- C92 H72 Cl8 O8 -","2","0.5","","Shan, Zhen; Wu, Miaomiao; Gu, Zhangjie; Nishiyama, Yusuke; Zhang, Gen","A non-planar 2D covalent organic framework derived from a Z-shaped building unit.","Chemical communications (Cambridge, England)","2021","57","73","9236","9239","10.1039/d1cc04103g","","","0.71073","MoKα","","0.0965","0.0786","","","0.2382","0.2642","","","","","","1.0648","","","","has coordinates","269616","2021-10-06","13:47:14",""
"7128866","16.376","0.0007","14.9059","0.0007","25.2682","0.001","90","","107.609","0.001","90","","5878.9","0.4","299.62","","299.62","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C59 H44 Mn3 N3 O11 -","- C59 H44 Mn3 N3 O11 -","- C236 H176 Mn12 N12 O44 -","4","1","","Yang, Chao; Liu, Dingqi; Wang, Tongshuai; Sun, Fuxing; Qiu, Shilun; Wu, Gang","Manganese-promoted cleavage of acetylacetonate resembling the β-diketone cleaving dioxygenase (Dke1) reactivity.","Chemical communications (Cambridge, England)","2021","57","74","9462","9465","10.1039/d1cc02774c","","","0.71073","MoKα","","0.0433","0.0332","","","0.0829","0.0886","","","","","","1.029","","","","has coordinates","269646","2021-10-06","13:57:38",""
"7128867","14.139","0.003","22.693","0.005","16.025","0.003","90","","95.846","0.007","90","","5115","1.8","273.15","","273.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C110 H80 K2 Mn6 N6 O26 -","- C110 H80 K2 Mn6 N6 O26 -","- C220 H160 K4 Mn12 N12 O52 -","2","0.5","","Yang, Chao; Liu, Dingqi; Wang, Tongshuai; Sun, Fuxing; Qiu, Shilun; Wu, Gang","Manganese-promoted cleavage of acetylacetonate resembling the β-diketone cleaving dioxygenase (Dke1) reactivity.","Chemical communications (Cambridge, England)","2021","57","74","9462","9465","10.1039/d1cc02774c","","","0.71073","MoKα","","0.1079","0.0765","","","0.2356","0.2589","","","","","","1.056","","","","has coordinates","269646","2021-10-06","13:57:38",""
"7128868","10.833","0.002","37.692","0.008","11.684","0.003","90","","91.393","0.007","90","","4769.4","1.8","273.15","","273.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H41 Mn3 N4 O10 -","- C46 H41 Mn3 N4 O10 -","- C184 H164 Mn12 N16 O40 -","4","1","","Yang, Chao; Liu, Dingqi; Wang, Tongshuai; Sun, Fuxing; Qiu, Shilun; Wu, Gang","Manganese-promoted cleavage of acetylacetonate resembling the β-diketone cleaving dioxygenase (Dke1) reactivity.","Chemical communications (Cambridge, England)","2021","57","74","9462","9465","10.1039/d1cc02774c","","","0.71073","MoKα","","0.098","0.0607","","","0.1556","0.1717","","","","","","1.05","","","","has coordinates","269646","2021-10-06","13:57:38",""
"7128869","7.946","0.009","8.073","0.01","39.47","0.05","90","","90","","90","","2532","5","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H33 Br O5 -","- C28 H33 Br O5 -","- C112 H132 Br4 O20 -","4","1","","Tsuchiya, Motoki; Maeda, Hazuki; Inoue, Ryo; Morisaki, Yasuhiro","Construction of helical structures with planar chiral [2.2]paracyclophane: fusing helical and planar chiralities.","Chemical communications (Cambridge, England)","2021","57","73","9256","9259","10.1039/d1cc03320d","","","0.71075","MoKα","","0.0462","0.0427","","","0.1055","0.1088","","","","","","1.1","","","","has coordinates,has disorder","269607","2021-10-06","13:43:46",""
"7128870","14.7972","0.0006","8.0733","0.0003","18.9373","0.0007","90","","96.319","0.004","90","","2248.55","0.15","123","","123","","","","","","","","","2","P 1 21 1","P 2yb","4","","","","- C32 H28 -","- C32 H28 -","- C128 H112 -","4","2","","Tsuchiya, Motoki; Maeda, Hazuki; Inoue, Ryo; Morisaki, Yasuhiro","Construction of helical structures with planar chiral [2.2]paracyclophane: fusing helical and planar chiralities.","Chemical communications (Cambridge, England)","2021","57","73","9256","9259","10.1039/d1cc03320d","","x-ray","0.71073","MoKα","","0.0865","0.0572","","","0.1113","0.1263","","","","","","1.008","","","","has coordinates","269607","2021-10-06","13:43:46",""
"7128871","11.0786","0.0007","15.0781","0.0009","15.4237","0.0009","90","","90","","90","","2576.4","0.3","123","","123","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","","","- C40 H28 -","- C40 H28 -","- C160 H112 -","4","1","","Tsuchiya, Motoki; Maeda, Hazuki; Inoue, Ryo; Morisaki, Yasuhiro","Construction of helical structures with planar chiral [2.2]paracyclophane: fusing helical and planar chiralities.","Chemical communications (Cambridge, England)","2021","57","73","9256","9259","10.1039/d1cc03320d","","x-ray","0.71073","MoKα","","0.1017","0.063","","","0.1076","0.1219","","","","","","1.015","","","","has coordinates","269607","2021-10-06","13:43:46",""
"7128872","8.2667","0.0012","12.9527","0.0018","9.9631","0.0016","90","","102.109","0.015","90","","1043.1","0.3","123","","123","","","","","","","","","2","P 1 21 1","P 2yb","4","","","","- C32 H24 -","- C32 H24 -","- C64 H48 -","2","1","","Tsuchiya, Motoki; Maeda, Hazuki; Inoue, Ryo; Morisaki, Yasuhiro","Construction of helical structures with planar chiral [2.2]paracyclophane: fusing helical and planar chiralities.","Chemical communications (Cambridge, England)","2021","57","73","9256","9259","10.1039/d1cc03320d","","x-ray","0.71073","MoKα","","0.1535","0.08","","","0.128","0.1571","","","","","","1.038","","","","has coordinates","269607","2021-10-06","13:43:46",""
"7128873","9.1381","0.0003","7.2746","0.0002","16.347","0.0005","90","","91.457","0.003","90","","1086.33","0.06","150","","150","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H27 Br O4 -","- C26 H27 Br O4 -","- C52 H54 Br2 O8 -","2","1","","Tsuchiya, Motoki; Maeda, Hazuki; Inoue, Ryo; Morisaki, Yasuhiro","Construction of helical structures with planar chiral [2.2]paracyclophane: fusing helical and planar chiralities.","Chemical communications (Cambridge, England)","2021","57","73","9256","9259","10.1039/d1cc03320d","","x-ray","0.71073","MoKα","","0.0417","0.0372","","","0.0851","0.088","","","","","","1.017","","","","has coordinates","269607","2021-10-06","13:43:46",""
"7128874","8.389","0.0002","21.6023","0.0006","30.9026","0.0008","90","","90","","90","","5600.2","0.3","150","","150","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","","","- C40 H32 -","- C40 H32 -","- C320 H256 -","8","2","","Tsuchiya, Motoki; Maeda, Hazuki; Inoue, Ryo; Morisaki, Yasuhiro","Construction of helical structures with planar chiral [2.2]paracyclophane: fusing helical and planar chiralities.","Chemical communications (Cambridge, England)","2021","57","73","9256","9259","10.1039/d1cc03320d","","x-ray","0.71073","MoKα","","0.163","0.0676","","","0.1009","0.125","","","","","","1","","","","has coordinates","269607","2021-10-06","13:43:46",""
"7128875","19.621","0.0013","7.3648","0.0005","25.7732","0.0017","90","","90","","90","","3724.3","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H19 N O3 -","- C24 H19 N O3 -","- C192 H152 N8 O24 -","8","1","","Prasad, Budaganaboyina; Phanindrudu, Mandalaparthi; Nanubolu, Jagadeesh Babu; Kamal, Ahmed; Tiwari, Dharmendra Kumar","Stereoselective synthesis of (<i>Z</i>)-1,3-bis(α,β-unsaturated carbonyl)-isoindolines from aldehydes and phenacyl azides under metal free conditions.","Chemical communications (Cambridge, England)","2021","57","75","9542","9545","10.1039/d1cc02884g","","","0.71073","MoKα","","0.0894","0.0521","","","0.1169","0.1352","","","","","","1.037","","","","has coordinates","269638","2021-10-06","13:55:46",""
"7128876","40.0469","0.0011","12.2563","0.0004","23.2462","0.0006","90","","108.059","0.001","90","","10847.8","0.5","150","","150","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C24 H82 As2 N10 Na2 O91 Rh2 W22 -","- C24 H82 As2 N10 Na2 O91 Rh2 W22 -","- C96 H328 As8 N40 Na8 O364 Rh8 W88 -","4","0.5","","Liu, Zhen; Zhang, Xue; Wan, Rong; Li, Huafeng; Hong, Yumei; Ma, Pengtao; Niu, Jingyang; Wang, Jingping","A Rh-substituted polyoxometalate with an acetate-modified building block {As<sub>2</sub>W<sub>22</sub>O<sub>76</sub>(CH<sub>3</sub>COO)<sub>2</sub>}.","Chemical communications (Cambridge, England)","2021","57","79","10250","10253","10.1039/d1cc03646g","","","0.71073","MoKα","","0.0324","0.0265","","","0.0554","0.0579","","","","","","1.031","","","","has coordinates","270367","2021-11-06","18:50:11",""
"7128877","5.1578","0.0003","8.9611","0.0004","9.5418","0.0005","92.623","0.002","103.752","0.001","95.143","0.002","425.62","0.04","170","2","170.02","","","","","","","","","5","P 1","P 1","1","","","","- C19 H21 N O2 S -","- C19 H21 N O2 S -","- C19 H21 N O2 S -","1","1","","Wu, Xiang; Ding, Du; Zhang, Ying; Jiang, Hua-Jie; Wang, Tao; Zhao, Li-Ping","Enantioselective synthesis of 1-aminoindene derivatives <i>via</i> asymmetric Brønsted acid catalysis.","Chemical communications (Cambridge, England)","2021","57","76","9680","9683","10.1039/d1cc03568a","","","1.34139","GaKα","","0.0374","0.0368","","","0.0916","0.0922","","","","","","1.071","","","","has coordinates","269635","2021-10-06","13:54:39",""
"7128878","8.1788","0.0003","7.7926","0.0003","16.7712","0.0006","90","","103.581","0.002","90","","1039.01","0.07","200","2","200","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H23 N O4 S -","- C24 H23 N O4 S -","- C48 H46 N2 O8 S2 -","2","1","","Wu, Xiang; Ding, Du; Zhang, Ying; Jiang, Hua-Jie; Wang, Tao; Zhao, Li-Ping","Enantioselective synthesis of 1-aminoindene derivatives <i>via</i> asymmetric Brønsted acid catalysis.","Chemical communications (Cambridge, England)","2021","57","76","9680","9683","10.1039/d1cc03568a","","","1.34139","GaKα","","0.0389","0.0356","","","0.0896","0.0926","","","","","","1.048","","","","has coordinates","269635","2021-10-06","13:54:49",""
"7128879","15.4942","0.0008","12.4379","0.0008","25.9022","0.0017","90","","90","","90","","4991.8","0.5","298","","298","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C50 H44 B2 F4 N4 O2 -","- C50 H44 B2 F4 N4 O2 -","- C200 H176 B8 F16 N16 O8 -","4","0.5","","Kang, Zhengxin; Wu, Qinghua; Guo, Xing; Wang, Long; Ye, Yin; Yu, Changjiang; Wang, Hua; Hao, Erhong; Jiao, Lijuan","FeCl<sub>3</sub>-promoted regioselective synthesis of BODIPY dimers through oxidative aromatic homocoupling reactions.","Chemical communications (Cambridge, England)","2021","57","77","9886","9889","10.1039/d1cc04098g","","","0.71073","MoKα","","0.1135","0.0846","","","0.2539","0.2974","","","","","","1.103","","","","has coordinates","269629","2021-10-06","13:50:32",""
"7128880","15.1048","0.0005","12.2629","0.0004","18.3629","0.0006","90","","90","","90","","3401.34","0.19","273.15","","273.15","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C36 H30 B2 Cl2 F4 N4 -","- C36 H30 B2 Cl2 F4 N4 -","- C144 H120 B8 Cl8 F16 N16 -","4","0.5","","Kang, Zhengxin; Wu, Qinghua; Guo, Xing; Wang, Long; Ye, Yin; Yu, Changjiang; Wang, Hua; Hao, Erhong; Jiao, Lijuan","FeCl<sub>3</sub>-promoted regioselective synthesis of BODIPY dimers through oxidative aromatic homocoupling reactions.","Chemical communications (Cambridge, England)","2021","57","77","9886","9889","10.1039/d1cc04098g","","","0.71073","MoKα","","0.0892","0.0713","","","0.1365","0.1492","","","","","","1.11","","","","has coordinates","269629","2021-10-06","13:50:33",""
"7128881","40.1788","0.0014","21.4061","0.0007","11.3403","0.0003","90","","90","","90","","9753.5","0.5","100","","100","","","","","","","","","6","P n a 21","P 2c -2n","33","","[(Et3PAg)3(PhSi)3S6]","","- C36 H60 Ag3 P3 S6 Si3 -","- C36 H60 Ag3 P3 S6 Si3 -","- C288 H480 Ag24 P24 S48 Si24 -","8","2","","Nier, Simon; Ringelband, Sven; Dehnen, Stefanie","Selective replacement of organosilicon units in the cluster [(PhSi)<sub>4</sub>S<sub>6</sub>] with coinage metal complex fragments.","Chemical communications (Cambridge, England)","2021","57","79","10254","10257","10.1039/d1cc04264e","","","0.71073","MoKα","","0.0384","0.0265","","","0.0522","0.0536","","","","","","0.906","","","","has coordinates","270363","2021-11-06","18:49:05",""
"7128882","19.0521","0.0009","19.7933","0.0008","21.5839","0.0009","107.582","0.003","115.295","0.003","99.475","0.003","6595.4","0.6","100","","100","","","","","","","","","8","P -1","-P 1","2","","Na2[(Me3PCu)(PhSi)3S6]","","- C103 H152 Cu3 Na6 O10 P3 S18 Si9 -","- C99 H144 Cu3 Na6 O9 P3 S18 Si9 -","- C198 H288 Cu6 Na12 O18 P6 S36 Si18 -","2","1","","Nier, Simon; Ringelband, Sven; Dehnen, Stefanie","Selective replacement of organosilicon units in the cluster [(PhSi)<sub>4</sub>S<sub>6</sub>] with coinage metal complex fragments.","Chemical communications (Cambridge, England)","2021","57","79","10254","10257","10.1039/d1cc04264e","","","0.71073","MoKα","","0.0582","0.0406","","","0.0984","0.1055","","","","","","1.036","","","","has coordinates","270363","2021-11-06","18:49:05",""
"7128883","15.67351","0.00012","34.78","0.0003","21.94284","0.00018","90","","90","","90","","11961.6","0.17","100.01","0.1","100.01","0.1","","","","","","","","7","C 2 2 21","C 2c 2","20","","","","- C113 H93 F18 Ir3 N17 O11 P3 -","- C113 H93 F18 Ir3 N17 O11 P3 -","- C452 H372 F72 Ir12 N68 O44 P12 -","4","0.5","","Sunohara, Haruka; Koyamada, Kenta; Takezawa, Hiroki; Fujita, Makoto","An Ir<sub>3</sub>L<sub>2</sub> complex with anion binding pockets: photocatalytic <i>E</i>-<i>Z</i> isomerization <i>via</i> molecular recognition.","Chemical communications (Cambridge, England)","2021","57","73","9300","9302","10.1039/d1cc03620c","","x-ray","1.54184","CuKα","","0.0346","0.031","","","0.079","0.0804","","","","","","1.056","","","","has coordinates,has disorder","269615","2021-10-06","13:46:59",""
"7128884","16.8732","0.0002","20.5915","0.0002","32.4982","0.0005","90","","90","","90","","11291.3","0.2","100.02","0.1","100.02","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C108 H78 F18 Ir3 N12 P3 -","- C108 H78 F18 Ir3 N12 P3 -","- C432 H312 F72 Ir12 N48 P12 -","4","1","","Sunohara, Haruka; Koyamada, Kenta; Takezawa, Hiroki; Fujita, Makoto","An Ir<sub>3</sub>L<sub>2</sub> complex with anion binding pockets: photocatalytic <i>E</i>-<i>Z</i> isomerization <i>via</i> molecular recognition.","Chemical communications (Cambridge, England)","2021","57","73","9300","9302","10.1039/d1cc03620c","","x-ray","1.54184","CuKα","","0.0846","0.0489","","","0.1004","0.1152","","","","","","0.962","","","","has coordinates","269615","2021-10-06","13:46:59",""
"7128885","11.9028","0.0005","12.0034","0.0005","12.1944","0.0005","79.154","0.001","81.444","0.001","62.787","0.001","1517.81","0.11","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C48 H106 Si12 -","- C48 H106 Si12 -","- C48 H106 Si12 -","1","0.5","","Nukazawa, Takumi; Iwamoto, Takeaki","π-Conjugated species with an unsupported Si-Si π-bond obtained from direct π-extension.","Chemical communications (Cambridge, England)","2021","57","76","9692","9695","10.1039/d1cc04332c","","","0.71073","MoKα","","0.0356","0.0304","","","0.0746","0.0786","","","","","","1.045","","","","has coordinates","269632","2021-10-06","13:52:29",""
"7128886","10.9137","0.0005","23.4184","0.0012","11.4842","0.0006","90","","90.487","0.001","90","","2935","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C48 H90 Si12 -","- C48 H90 Si12 -","- C96 H180 Si24 -","2","0.5","","Nukazawa, Takumi; Iwamoto, Takeaki","π-Conjugated species with an unsupported Si-Si π-bond obtained from direct π-extension.","Chemical communications (Cambridge, England)","2021","57","76","9692","9695","10.1039/d1cc04332c","","","0.71073","MoKα","","0.0479","0.04","","","0.0979","0.1013","","","","","","1.076","","","","has coordinates","269632","2021-10-06","13:52:41",""
"7128887","9.5459","0.0014","11.7033","0.0017","12.1756","0.0017","70.756","0.005","84.677","0.005","67.243","0.005","1183.3","0.3","150","2","150.15","","","","","","","","","7","P -1","-P 1","2","","","","- C23 H24 Cl2 N2 O Ru S2 -","- C23 H24 Cl2 N2 O Ru S2 -","- C46 H48 Cl4 N4 O2 Ru2 S4 -","2","1","","Dhara, Debabrata; Pal, Pradeep Kumar; Dolai, Ramapada; Chrysochos, Nicolas; Rawat, Hemant; Elvers, Benedict J.; Krummenacher, Ivo; Braunschweig, Holger; Schulzke, Carola; Chandrasekhar, Vadapalli; Priyakumar, U. Deva; Jana, Anukul","Synthesis and reactivity of NHC-coordinated phosphinidene oxide.","Chemical communications (Cambridge, England)","2021","57","75","9546","9549","10.1039/d1cc04421d","","","0.71073","MoKα","","0.0747","0.0453","","","0.0926","0.1042","","","","","","1.027","","","","has coordinates","269637","2021-10-06","13:55:38",""
"7128888","8.057","0.0006","14.0475","0.0013","12.2644","0.0009","90","","95.457","0.006","90","","1381.8","0.19","298.16","0.1","298.16","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C31 H37 N2 O P -","- C31 H37 N2 O P -","- C62 H74 N4 O2 P2 -","2","1","","Dhara, Debabrata; Pal, Pradeep Kumar; Dolai, Ramapada; Chrysochos, Nicolas; Rawat, Hemant; Elvers, Benedict J.; Krummenacher, Ivo; Braunschweig, Holger; Schulzke, Carola; Chandrasekhar, Vadapalli; Priyakumar, U. Deva; Jana, Anukul","Synthesis and reactivity of NHC-coordinated phosphinidene oxide.","Chemical communications (Cambridge, England)","2021","57","75","9546","9549","10.1039/d1cc04421d","","x-ray","0.71073","MoKα","","0.0876","0.0681","","","0.185","0.197","","","","","","1.055","","","","has coordinates","269637","2021-10-06","13:55:39",""
"7128889","14.0017","0.001","14.1141","0.0008","14.6959","0.0011","90","","109.903","0.008","90","","2730.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H37 N2 O2 P -","- C31 H37 N2 O2 P -","- C124 H148 N8 O8 P4 -","4","1","","Dhara, Debabrata; Pal, Pradeep Kumar; Dolai, Ramapada; Chrysochos, Nicolas; Rawat, Hemant; Elvers, Benedict J.; Krummenacher, Ivo; Braunschweig, Holger; Schulzke, Carola; Chandrasekhar, Vadapalli; Priyakumar, U. Deva; Jana, Anukul","Synthesis and reactivity of NHC-coordinated phosphinidene oxide.","Chemical communications (Cambridge, England)","2021","57","75","9546","9549","10.1039/d1cc04421d","","","0.71073","MoKα","","0.1066","0.0609","","","0.1371","0.1558","","","","","","1.015","","","","has coordinates","269637","2021-10-06","13:55:39",""
"7128890","13.406","0.003","14.783","0.003","30.449","0.006","99.67","0.03","102.51","0.03","96.47","0.03","5737","2","170","2","170.15","","","","","","","","","6","P -1","-P 1","2","","","","- C64 H71 K2 N2 O2 P2 -","- C64 H71 K2 N2 O2 P2 -","- C256 H284 K8 N8 O8 P8 -","4","2","","Dhara, Debabrata; Pal, Pradeep Kumar; Dolai, Ramapada; Chrysochos, Nicolas; Rawat, Hemant; Elvers, Benedict J.; Krummenacher, Ivo; Braunschweig, Holger; Schulzke, Carola; Chandrasekhar, Vadapalli; Priyakumar, U. Deva; Jana, Anukul","Synthesis and reactivity of NHC-coordinated phosphinidene oxide.","Chemical communications (Cambridge, England)","2021","57","75","9546","9549","10.1039/d1cc04421d","","","0.71073","MoKα","","0.1286","0.0656","","","0.1632","0.194","","","","","","1.02","","","","has coordinates","295543","2024-10-18","15:17:09",""
"7128891","38.1631","0.0019","9.9045","0.0006","8.5781","0.0005","90","","90","","90","","3242.4","0.3","293","2","293","2","","","","","","","","6","P n n 2","P 2 -2n","34","","","","- C31 H38 F6 N2 P Sb -","- C31 H38 F6 N2 P Sb -","- C124 H152 F24 N8 P4 Sb4 -","4","1","","Dhara, Debabrata; Pal, Pradeep Kumar; Dolai, Ramapada; Chrysochos, Nicolas; Rawat, Hemant; Elvers, Benedict J.; Krummenacher, Ivo; Braunschweig, Holger; Schulzke, Carola; Chandrasekhar, Vadapalli; Priyakumar, U. Deva; Jana, Anukul","Synthesis and reactivity of NHC-coordinated phosphinidene oxide.","Chemical communications (Cambridge, England)","2021","57","75","9546","9549","10.1039/d1cc04421d","","","0.71073","MoKα","","0.094","0.0624","","","0.1564","0.1737","","","","","","1.014","","","","has coordinates,has disorder","269637","2021-10-06","13:55:39",""
"7128892","12.6743","0.0002","14.2432","0.0003","20.3249","0.0007","93.375","0.002","91.737","0.002","108.005","0.002","3478.82","0.16","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C63 H78 Cl2 F12 N4 O4 P2 Sb2 -","- C63 H78 Cl2 F12 N4 O4 P2 Sb2 -","- C126 H156 Cl4 F24 N8 O8 P4 Sb4 -","2","1","","Dhara, Debabrata; Pal, Pradeep Kumar; Dolai, Ramapada; Chrysochos, Nicolas; Rawat, Hemant; Elvers, Benedict J.; Krummenacher, Ivo; Braunschweig, Holger; Schulzke, Carola; Chandrasekhar, Vadapalli; Priyakumar, U. Deva; Jana, Anukul","Synthesis and reactivity of NHC-coordinated phosphinidene oxide.","Chemical communications (Cambridge, England)","2021","57","75","9546","9549","10.1039/d1cc04421d","","","0.71073","MoKα","","0.1003","0.0886","","","0.2396","0.2498","","","","","","1.06","","","","has coordinates,has disorder","269637","2021-10-06","13:55:39",""
"7128893","25.6297","0.0008","6.39261","0.00018","12.469","0.0003","90","","114.818","0.003","90","","1854.26","0.1","223","2","223","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C22 H20 N2 O3 -","- C22 H20 N2 O3 -","- C88 H80 N8 O12 -","4","1","","Liu, Hua-Wei; Wang, Dian-Liang; Jiang, Nan-Quan; Li, Hai-Yan; Cai, Zhong-Jian; Ji, Shun-Jun","Divergent synthesis of α-functionalized amides through selective N-O/C-C or N-O/C-C/C-N cleavage of aza-cyclobutanone oxime esters.","Chemical communications (Cambridge, England)","2021","57","75","9618","9621","10.1039/d1cc03348d","","","1.54178","CuKα","","0.0609","0.0559","","","0.1382","0.1455","","","","","","0.894","","","","has coordinates","269639","2021-10-06","13:55:54",""
"7128894","14.5103","0.0009","10.8097","0.0007","9.4091","0.0005","90","","93.534","0.006","90","","1473.03","0.15","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 F3 N O3 -","- C14 H15 F3 N O3 -","- C56 H60 F12 N4 O12 -","4","1","","Liu, Hua-Wei; Wang, Dian-Liang; Jiang, Nan-Quan; Li, Hai-Yan; Cai, Zhong-Jian; Ji, Shun-Jun","Divergent synthesis of α-functionalized amides through selective N-O/C-C or N-O/C-C/C-N cleavage of aza-cyclobutanone oxime esters.","Chemical communications (Cambridge, England)","2021","57","75","9618","9621","10.1039/d1cc03348d","","","1.54184","CuKα","","0.1107","0.1005","","","0.313","0.3419","","","","","","1.055","","","","has coordinates,has disorder","269639","2021-10-06","13:55:55",""
"7128895","10.6842","0.0017","10.8749","0.0017","12.429","0.002","91.808","0.002","111.391","0.002","101.478","0.002","1309.1","0.4","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","3'-azido-2'-(1H-benzo[d]imidazol-1-yl)-1H,3'H-3,3'-biindole","","- C23 H15 N7 -","- C23 H15 N7 -","- C46 H30 N14 -","2","1","","Liu, Xiaoyu; He, Kun; Gao, Na; Jiang, Peiyun; Lin, Jun; Jin, Yi","A radical-mediated multicomponent cascade reaction for the synthesis of azide-biindole derivatives.","Chemical communications (Cambridge, England)","2021","57","76","9696","9699","10.1039/d1cc03853b","","","0.71073","MoKα","","0.1128","0.0669","","","0.1995","0.2246","","","","","","1.186","","","","has coordinates","269633","2021-10-06","13:53:31",""
"7128896","8.0191","0.001","10.4708","0.0013","13.007","0.0016","68.608","0.005","84.564","0.005","75.181","0.004","983.1","0.2","170","2","170","","","","","","","","","3","P -1","-P 1","2","","3'-azido-7,7'-dimethyl-2'-(4-methyl-1H-imidazol-1-yl)-1H,3'H-3,3'-biindole","","- C22 H19 N7 -","- C22 H19 N7 -","- C44 H38 N14 -","2","1","","Liu, Xiaoyu; He, Kun; Gao, Na; Jiang, Peiyun; Lin, Jun; Jin, Yi","A radical-mediated multicomponent cascade reaction for the synthesis of azide-biindole derivatives.","Chemical communications (Cambridge, England)","2021","57","76","9696","9699","10.1039/d1cc03853b","","","0.71073","MoKα","","0.0901","0.0514","","","0.1214","0.1445","","","","","","1.04","","","","has coordinates","269633","2021-10-06","13:54:06",""
"7128897","7.196","0.005","19.955","0.015","24.468","0.018","90","0.005","90.05","0.001","90","0.005","3514","4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H16 N4 -","- C23 H15.5 N4 -","- C184 H124 N32 -","8","2","","Liu, Xiaoyu; He, Kun; Gao, Na; Jiang, Peiyun; Lin, Jun; Jin, Yi","A radical-mediated multicomponent cascade reaction for the synthesis of azide-biindole derivatives.","Chemical communications (Cambridge, England)","2021","57","76","9696","9699","10.1039/d1cc03853b","","","0.71073","MoKα","","0.1983","0.0621","","","0.0985","0.1289","","","","","","0.757","","","","has coordinates","295862","2024-11-09","12:08:11",""
"7128898","12.375","0.0009","13.3822","0.0008","20.4459","0.0013","101.724","0.005","90.576","0.005","109.974","0.006","3104.2","0.4","291.4","0.4","291.4","0.4","","","","","","","","5","P -1","-P 1","2","","","","- C65 H66 N2 O20 Zn -","- C65 H65 N2 O20 Zn -","- C130 H130 N4 O40 Zn2 -","2","1","","Zhong, Kaipeng; Lu, Siyu; Guo, Wenting; Su, Junxia; Sun, Shihao; Hai, Jun; Wang, Baodui","NIR emissive light-harvesting systems through perovskite passivation and sequential energy transfer for third-level fingerprint imaging.","Chemical communications (Cambridge, England)","2021","57","74","9434","9437","10.1039/d1cc03006j","","x-ray","0.71","MoKα","","0.1785","0.0959","","","0.2288","0.2947","","","","","","1.021","","","","has coordinates","269647","2021-10-06","13:57:46",""
"7128899","14.0903","0.0005","14.7705","0.0004","17.8312","0.0007","72.082","0.003","84.734","0.003","88.356","0.003","3516.1","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H60 Cl5 Cu4 N4 O4 P4 -","- C70 H60 Cl5 Cu4 N4 O4 P4 -","- C140 H120 Cl10 Cu8 N8 O8 P8 -","2","1","","Huang, Qiu-Qin; Hu, Mei-Yue; Li, Yan-Li; Chen, Nan-Nan; Li, Yi; Wei, Qiao-Hua; Fu, FengFu","Novel ultrabright luminescent copper nanoclusters and application in light-emitting devices.","Chemical communications (Cambridge, England)","2021","57","77","9890","9893","10.1039/d1cc03799d","","","0.71073","MoKα","","0.0534","0.0429","","","0.1291","0.1346","","","","","","1.153","","","","has coordinates","269626","2021-10-06","13:50:06",""
"7128900","49.294","0.003","12.7809","0.0006","23.0005","0.0013","90","","98.205","0.004","90","","14342.5","1.4","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C71 H60 Cl6 Cu3 N4 O9 P4 -","- C71 H60 Cl6 Cu3 N4 O9 P4 -","- C568 H480 Cl48 Cu24 N32 O72 P32 -","8","1","","Huang, Qiu-Qin; Hu, Mei-Yue; Li, Yan-Li; Chen, Nan-Nan; Li, Yi; Wei, Qiao-Hua; Fu, FengFu","Novel ultrabright luminescent copper nanoclusters and application in light-emitting devices.","Chemical communications (Cambridge, England)","2021","57","77","9890","9893","10.1039/d1cc03799d","","","0.71073","MoKα","","0.1004","0.0754","","","0.2201","0.2396","","","","","","1.047","","","","has coordinates","269626","2021-10-06","13:50:07",""
"7128901","19.304","0.003","8.5274","0.0012","21.312","0.003","90","","102.919","0.008","90","","3419.4","0.9","110","2","110","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H32 B Cl F4 O2 P -","- C41 H32 B Cl F4 O2 P -","- C164 H128 B4 Cl4 F16 O8 P4 -","4","1","","Zhou, Jiliang; Litle, Elishua D.; Gabbaï, François P","Isolation and reactivity of a gold(I) hydroxytrifluoroborate complex stabilized by anion-π<sup>+</sup> interactions.","Chemical communications (Cambridge, England)","2021","57","79","10154","10157","10.1039/d1cc04105c","","","1.54178","CuKα","","0.0708","0.0655","","","0.1585","0.1629","","","","","","1.032","","","","has coordinates,has disorder","270362","2021-11-06","18:48:29",""
"7128902","12.0811","0.0017","27.755","0.004","13.1547","0.0018","90","","113.191","0.005","90","","4054.5","1","110","2","110","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C44 H38 Au B2 F8 O2 P S -","- C44 H38 Au B2 F8 O2 P S -","- C176 H152 Au4 B8 F32 O8 P4 S4 -","4","1","","Zhou, Jiliang; Litle, Elishua D.; Gabbaï, François P","Isolation and reactivity of a gold(I) hydroxytrifluoroborate complex stabilized by anion-π<sup>+</sup> interactions.","Chemical communications (Cambridge, England)","2021","57","79","10154","10157","10.1039/d1cc04105c","","","1.54178","CuKα","","0.0482","0.0418","","","0.1053","0.1119","","","","","","1.038","","","","has coordinates","270362","2021-11-06","18:48:29",""
"7128903","9.1127","0.0009","12.1329","0.0012","19.0254","0.0019","72.006","0.003","88.804","0.004","77.425","0.004","1950.2","0.3","110","2","110","","","","","","","","","8","P -1","-P 1","2","","","","- C47 H38 Au B Cl F4 O2 P -","- C47 H38 Au B Cl F4 O2 P -","- C94 H76 Au2 B2 Cl2 F8 O4 P2 -","2","1","","Zhou, Jiliang; Litle, Elishua D.; Gabbaï, François P","Isolation and reactivity of a gold(I) hydroxytrifluoroborate complex stabilized by anion-π<sup>+</sup> interactions.","Chemical communications (Cambridge, England)","2021","57","79","10154","10157","10.1039/d1cc04105c","","","0.71073","MoKα","","0.0202","0.0182","","","0.0444","0.0452","","","","","","1.046","","","","has coordinates,has disorder","270362","2021-11-06","18:48:29",""
"7128904","30.17","0.003","10.7619","0.001","25.281","0.003","90","","97.643","0.004","90","","8135.5","1.5","110","2","110","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C46 H39.7 Au B2 F8.06 O3 P -","- C46 H39.7 Au B2 F8.06 O3 P -","- C368 H317.6 Au8 B16 F64.48 O24 P8 -","8","1","","Zhou, Jiliang; Litle, Elishua D.; Gabbaï, François P","Isolation and reactivity of a gold(I) hydroxytrifluoroborate complex stabilized by anion-π<sup>+</sup> interactions.","Chemical communications (Cambridge, England)","2021","57","79","10154","10157","10.1039/d1cc04105c","","","0.71073","MoKα","","0.0604","0.0491","","","0.1127","0.1171","","","","","","1.16","","","","has coordinates,has disorder","270362","2021-11-06","18:48:29",""
"7128905","19.211","0.002","8.5749","0.0009","12.3647","0.0013","90","","97.328","0.007","90","","2020.2","0.4","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 Na O6 P -","- C22 H20 Na O6 P -","- C88 H80 Na4 O24 P4 -","4","1","","Thiele, Maike; Octa-Smolin, Frescilia; Thölke, Simon; Wölper, Christoph; Linders, Jürgen; Mayer, Christian; Haberhauer, Gebhard; Niemeyer, Jochen","A supramolecular double-helix based on complementary phosphate-guanidinium pairing.","Chemical communications (Cambridge, England)","2021","57","77","9842","9845","10.1039/d1cc04644f","","","0.71073","MoKα","","0.1092","0.049","","","0.1114","0.1348","","","","","","1.011","","","","has coordinates","269622","2021-10-06","13:49:08",""
"7128906","8.8577","0.0002","8.9307","0.0002","18.7699","0.0004","91.7","0.001","93.975","0.001","108.2","0.001","1405.06","0.05","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","","","- C23 H20 Br N3 -","- C23 H20 Br N3 -","- C46 H40 Br2 N6 -","2","1","","Thiele, Maike; Octa-Smolin, Frescilia; Thölke, Simon; Wölper, Christoph; Linders, Jürgen; Mayer, Christian; Haberhauer, Gebhard; Niemeyer, Jochen","A supramolecular double-helix based on complementary phosphate-guanidinium pairing.","Chemical communications (Cambridge, England)","2021","57","77","9842","9845","10.1039/d1cc04644f","","","0.71073","MoKα","","0.0594","0.0464","","","0.1161","0.1212","","","","","","1.052","","","","has coordinates","269622","2021-10-06","13:49:09",""
"7128907","10.158","0.005","9.42","0.004","12.633","0.005","90","","108.94","0.02","90","","1143.4","0.9","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H24 I N O2 -","- C27 H24 I N O2 -","- C54 H48 I2 N2 O4 -","2","1","","Thiele, Maike; Octa-Smolin, Frescilia; Thölke, Simon; Wölper, Christoph; Linders, Jürgen; Mayer, Christian; Haberhauer, Gebhard; Niemeyer, Jochen","A supramolecular double-helix based on complementary phosphate-guanidinium pairing.","Chemical communications (Cambridge, England)","2021","57","77","9842","9845","10.1039/d1cc04644f","","","0.71073","MoKα","","0.0562","0.0544","","","0.1375","0.1386","","","","","","1.052","","","","has coordinates","269622","2021-10-06","13:49:09",""
"7128908","18.1178","0.0012","19.5762","0.0012","22.3911","0.0012","80.708","0.003","72.212","0.002","86.459","0.003","7462.1","0.8","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C44.92 H38.29 N3 O5.43 P -","- C44.9313 H38.2875 N3 O5.42813 P -","- C359.45 H306.3 N24 O43.4251 P8 -","8","4","","Thiele, Maike; Octa-Smolin, Frescilia; Thölke, Simon; Wölper, Christoph; Linders, Jürgen; Mayer, Christian; Haberhauer, Gebhard; Niemeyer, Jochen","A supramolecular double-helix based on complementary phosphate-guanidinium pairing.","Chemical communications (Cambridge, England)","2021","57","77","9842","9845","10.1039/d1cc04644f","","","0.71073","MoKα","","0.0928","0.0545","","","0.1377","0.1584","","","","","","1.032","","","","has coordinates,has disorder","269622","2021-10-06","13:49:09",""
"7128909","11.8508","0.0016","9.1039","0.0012","13.2298","0.0017","90","","115.219","0.006","90","","1291.3","0.3","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H27 I2 N O3 -","- C28 H27 I2 N O3 -","- C56 H54 I4 N2 O6 -","2","1","","Thiele, Maike; Octa-Smolin, Frescilia; Thölke, Simon; Wölper, Christoph; Linders, Jürgen; Mayer, Christian; Haberhauer, Gebhard; Niemeyer, Jochen","A supramolecular double-helix based on complementary phosphate-guanidinium pairing.","Chemical communications (Cambridge, England)","2021","57","77","9842","9845","10.1039/d1cc04644f","","","1.54178","CuKα","","0.0468","0.0427","","","0.1045","0.1088","","","","","","1.064","","","","has coordinates","269622","2021-10-06","13:49:09",""
"7128910","10.0422","0.0003","10.0422","0.0003","53.3248","0.0016","90","","90","","90","","5377.6","0.3","104","2","104","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C64 H52 N2 O4 -","- C64 H52 N2 O4 -","- C256 H208 N8 O16 -","4","0.5","","Thiele, Maike; Octa-Smolin, Frescilia; Thölke, Simon; Wölper, Christoph; Linders, Jürgen; Mayer, Christian; Haberhauer, Gebhard; Niemeyer, Jochen","A supramolecular double-helix based on complementary phosphate-guanidinium pairing.","Chemical communications (Cambridge, England)","2021","57","77","9842","9845","10.1039/d1cc04644f","","","1.54178","CuKα","","0.0478","0.0453","","","0.1187","0.1217","","","","","","1.028","","","","has coordinates,has disorder","269622","2021-10-06","13:49:09",""
"7128911","8.7397","0.0004","10.7629","0.0005","11.1283","0.0005","65.037","0.004","75.059","0.004","70.54","0.004","886.32","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- H32 K2 Ni2 O44 V10 -","- H32 K2 Ni2 O44 V10 -","- H32 K2 Ni2 O44 V10 -","1","0.5","","Jana, Debu; Kolli, Hema Kumari; Sabnam, Subhashree; Das, Samar K.","Efficient homogeneous electrocatalytic hydrogen evolution using a Ni-containing polyoxometalate catalyst.","Chemical communications (Cambridge, England)","2021","57","77","9910","9913","10.1039/d1cc03605j","","","0.71073","MoKα","","0.0771","0.0725","","","0.1967","0.2074","","","","","","1.042","","","","has coordinates","269623","2021-10-06","13:49:20",""
"7128912","71.01","0.004","16.0851","0.001","49.267","0.002","90","","99.2","0.005","90","","55549","5","170","2","170","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C258 H300 F24 N24 O64 Rh8 S8 -","- C241 H232 F3 N24 O22 Rh8 S -","- C1928 H1856 F24 N192 O176 Rh64 S8 -","8","1","","Wang, Qi-Li-Sha; Lin, Yue-Jian; Jin, Guo-Xin","Same knot, longer rope: altering ligand geometry provides control over nuclearity in self-assembled trefoil knots.","Chemical communications (Cambridge, England)","2021","57","76","9772","9775","10.1039/d1cc03699h","","","1.54178","CuKα","","0.1506","0.104","","","0.2942","0.3509","","","","","","1.067","","","","has coordinates","269630","2021-10-06","13:51:49",""
"7128913","11.7168","0.0009","16.8296","0.0012","20.3839","0.0014","68.846","0.004","87.425","0.004","87.035","0.004","3742.1","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H84 F6 N4 O22 Rh2 S2 -","- C64 H62 F6 N4 O18 Rh2 S2 -","- C128 H124 F12 N8 O36 Rh4 S4 -","2","1","","Wang, Qi-Li-Sha; Lin, Yue-Jian; Jin, Guo-Xin","Same knot, longer rope: altering ligand geometry provides control over nuclearity in self-assembled trefoil knots.","Chemical communications (Cambridge, England)","2021","57","76","9772","9775","10.1039/d1cc03699h","","","1.54178","CuKα","","0.0517","0.0447","","","0.1269","0.132","","","","","","1.046","","","","has coordinates,has disorder","269630","2021-10-06","13:51:56",""
"7128914","18.764","0.0013","20.0235","0.0012","23.0409","0.0015","111.167","0.004","104.102","0.004","94.488","0.004","7696.2","0.9","173","2","173","","","","","","","","","7","P -1","-P 1","2","","","","- C138 H172 F12 N14 O41 Rh4 S4 -","- C123 H118 F6 N12 O21 Rh4 S2 -","- C246 H236 F12 N24 O42 Rh8 S4 -","2","1","","Wang, Qi-Li-Sha; Lin, Yue-Jian; Jin, Guo-Xin","Same knot, longer rope: altering ligand geometry provides control over nuclearity in self-assembled trefoil knots.","Chemical communications (Cambridge, England)","2021","57","76","9772","9775","10.1039/d1cc03699h","","","1.54178","CuKα","","0.1772","0.1095","","","0.2902","0.3584","","","","","","1","","","","has coordinates","269630","2021-10-06","13:51:58",""
"7128915","23.6578","0.0011","23.679","0.0011","23.8109","0.0011","119.776","0.002","98.285","0.002","91.895","0.002","11371.5","0.9","154","2","154","2","","","","","","","","7","P -1","-P 1","2","","","","- C194 H240 F18 N18 O52 Rh6 S6 -","- C186 H182 F15 N18 O30 Rh6 S5 -","- C372 H364 F30 N36 O60 Rh12 S10 -","2","1","","Wang, Qi-Li-Sha; Lin, Yue-Jian; Jin, Guo-Xin","Same knot, longer rope: altering ligand geometry provides control over nuclearity in self-assembled trefoil knots.","Chemical communications (Cambridge, England)","2021","57","76","9772","9775","10.1039/d1cc03699h","","","1.34138","GaKα","","0.1039","0.081","","","0.2032","0.2139","","","","","","1.056","","","","has coordinates,has disorder","269630","2021-10-06","13:51:58",""
"7128916","6.839","0.003","10.851","0.005","18.519","0.008","90","","90","","90","","1374.3","1.1","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- I Na7 O15 S3 -","- I Na7 O15 S3 -","- I4 Na28 O60 S12 -","4","1","","Ding, Mengmeng; Yu, Hongwei; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng","Na<sub>7</sub>(IO<sub>3</sub>)(SO<sub>4</sub>)<sub>3</sub>: the first noncentrosymmetric alkaline-metal iodate-sulfate with isolated [IO<sub>3</sub>] and [SO<sub>4</sub>] units.","Chemical communications (Cambridge, England)","2021","57","75","9598","9601","10.1039/d1cc03483a","","","0.71073","MoKα","","0.0751","0.05","","","0.0899","0.1008","","","","","","1.119","","","","has coordinates","269643","2021-10-06","13:56:34",""
"7128919","13.1699","0.0004","6.7473","0.0002","16.9652","0.0006","90","","94.13","0.001","90","","1503.63","0.08","170","2","170","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 O3 -","- C18 H20 O3 -","- C72 H80 O12 -","4","1","","Fan, Junjie; Fu, Chunling; Wu, Xiaoyan; Ma, Shengming","Rh-Catalyzed cyclization of 2,3-allenoic acids in the presence of 2,3-allenols.","Chemical communications (Cambridge, England)","2021","57","80","10411","10414","10.1039/d1cc04367f","","","0.71073","MoKα","","0.0475","0.0387","","","0.099","0.106","","","","","","1.025","","","","has coordinates","270373","2021-11-06","18:51:51",""
"7128920","7.449","0.005","10.164","0.008","11.085","0.006","115.47","0.02","98.08","0.02","92.02","0.03","745.9","0.9","296","","296","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H10 F6 N2 O4 -","- C12 H10 F6 N2 O4 -","- C24 H20 F12 N4 O8 -","2","1","","Sawano, Takahiro; Matsui, Takeshi; Koga, Marina; Ishikawa, Eri; Takeuchi, Ryo","Iridium-catalyzed C3-selective asymmetric allylation of 7-azaindoles with secondary allylic alcohols.","Chemical communications (Cambridge, England)","2021","57","76","9684","9687","10.1039/d1cc03968g","","","0.71075","MoKα","","0.1356","0.0671","","","0.1853","0.2212","","","","","","1.049","","","","has coordinates","269634","2021-10-06","13:54:28",""
"7128921","8.928","0.005","17.983","0.01","9.771","0.006","90","","93.34","0.02","90","","1566.1","1.6","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H15 Br N2 -","- C17 H15 Br N2 -","- C68 H60 Br4 N8 -","4","2","","Sawano, Takahiro; Matsui, Takeshi; Koga, Marina; Ishikawa, Eri; Takeuchi, Ryo","Iridium-catalyzed C3-selective asymmetric allylation of 7-azaindoles with secondary allylic alcohols.","Chemical communications (Cambridge, England)","2021","57","76","9684","9687","10.1039/d1cc03968g","","","0.71075","MoKα","","0.092","0.0513","","","0.1209","0.14","","","","","","0.931","","","","has coordinates","269634","2021-10-06","13:54:28",""
"7128922","9.7351","0.0002","34.9337","0.0007","11.2629","0.0002","90","","95.467","0.001","90","","3812.9","0.13","102","2","102","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H49 Al3 Cl2 N4 -","- C37 H49 Al3 Cl2 N4 -","- C148 H196 Al12 Cl8 N16 -","4","1","","Villegas-Escobar, Nery; Martínez, Javier; Matute, Ricardo A.; Saltarini, Sebastián; Daniliuc, Constantin G.; Gade, Lutz H.; Rojas, René S","Trapping an unusual pentacoordinate carbon atom in a neutral trialuminum complex.","Chemical communications (Cambridge, England)","2021","57","80","10327","10330","10.1039/d1cc04265c","","","1.54178","CuKα","","0.0466","0.0399","","","0.0995","0.1032","","","","","","1.082","","","","has coordinates,has disorder","270369","2021-11-06","18:51:03",""
"7128923","19.922","0.004","20.19","0.005","21.414","0.003","69.72","0.015","63.048","0.012","80.939","0.017","7202","3","153","2","153","2","","","","","","","","6","P 1","P 1","1","","","","- C131.5 H143.5 Cl10.5 N8 Ni2 S -","- C131.5 H143.5 Cl10.5 N8 Ni2 S -","- C263 H287 Cl21 N16 Ni4 S2 -","2","2","","Nishimura, Issei; Higashino, Tomohiro; Imahori, Hiroshi","Synthesis of thiophene-fused porphyrin dimers as effective π-extended helical chromophores.","Chemical communications (Cambridge, England)","2021","57","75","9606","9609","10.1039/d1cc04215g","","","0.71075","MoKα","","0.2511","0.1317","","","0.282","0.3652","","","","","","1.047","","","","has coordinates,has disorder","295862","2024-11-09","12:08:11",""
"7128924","8.123","0.005","8.21","0.005","10.595","0.005","100.833","0.005","110.172","0.005","90.315","0.005","649.5","0.6","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H15 B N4 O2 -","- C12 H15 B N4 O2 -","- C24 H30 B2 N8 O4 -","2","1","","Singh, Akansha; Kumar, Ravindra","Sustainable Passerini-tetrazole three component reaction (PT-3CR): selective synthesis of oxaborol-tetrazoles.","Chemical communications (Cambridge, England)","2021","57","76","9708","9711","10.1039/d1cc03256a","","","0.71073","MoKα","","0.0431","0.0398","","","0.1067","0.1099","","","","","","1.073","","","","has coordinates","269631","2021-10-06","13:52:10",""
"7128925","19.3179","0.0001","11.156","0.0001","27.3475","0.0002","90","","101.707","0.001","90","","5771.07","0.08","160","","160","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C65 H50 -","- C65 H50 -","- C260 H200 -","4","1","","Hu, Jinlian; Xiang, Qin; Xu, Jun; Xu, Zhanqiang; Chen, Guang; Sun, Zhe","Stable and twisted 5,6:12,13-dinaphthozethrene from angular π-extension.","Chemical communications (Cambridge, England)","2021","57","76","9712","9715","10.1039/d1cc04113d","","","1.54184","CuKα","","0.0515","0.0482","","","0.1465","0.1504","","","","","","1.023","","","","has coordinates","269636","2021-10-06","13:55:05",""
"7128934","14.9375","0.0005","12.7705","0.0004","31.6136","0.001","90","","90","","90","","6030.6","0.3","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C31 H43 Cl N4 Pt -","- C31 H43 Cl N4 Pt -","- C248 H344 Cl8 N32 Pt8 -","8","1","","He, Fengkai; Gourlaouen, Christophe; Pang, Huan; Braunstein, Pierre","Imidazolium salts and [Pt(cod)<sub>2</sub>]: from NHC hydrido complexes to the unprecedented olefinic tetrahedral cluster [Pt<sub>4</sub>(μ-H)(cod)<sub>4</sub>]BF<sub>4</sub>.","Chemical communications (Cambridge, England)","2021","57","78","10039","10042","10.1039/d1cc03673d","","","0.71073","MoKα","","0.0537","0.0332","","","0.0701","0.0796","","","","","","1.07","","","","has coordinates,has disorder","269604","2021-10-06","13:42:15",""
"7128935","64.377","0.003","9.8222","0.0004","14.9522","0.0005","90","","101.641","0.001","90","","9260.2","0.7","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C49 H61 Cl N4 O4 Pt -","- C49 H61 Cl N4 O4 Pt -","- C392 H488 Cl8 N32 O32 Pt8 -","8","1","","He, Fengkai; Gourlaouen, Christophe; Pang, Huan; Braunstein, Pierre","Imidazolium salts and [Pt(cod)<sub>2</sub>]: from NHC hydrido complexes to the unprecedented olefinic tetrahedral cluster [Pt<sub>4</sub>(μ-H)(cod)<sub>4</sub>]BF<sub>4</sub>.","Chemical communications (Cambridge, England)","2021","57","78","10039","10042","10.1039/d1cc03673d","","","0.71073","MoKα","","0.0244","0.0196","","","0.0379","0.04","","","","","","1.07","","","","has coordinates,has disorder","269604","2021-10-06","13:42:15",""
"7128936","21.3229","0.0016","12.7436","0.0012","15.3117","0.0014","90","","132.571","0.003","90","","3064.1","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H51 B F4 Pt4 -","- C32 H48 B F4 Pt4 -","- C128 H192 B4 F16 Pt16 -","4","0.5","","He, Fengkai; Gourlaouen, Christophe; Pang, Huan; Braunstein, Pierre","Imidazolium salts and [Pt(cod)<sub>2</sub>]: from NHC hydrido complexes to the unprecedented olefinic tetrahedral cluster [Pt<sub>4</sub>(μ-H)(cod)<sub>4</sub>]BF<sub>4</sub>.","Chemical communications (Cambridge, England)","2021","57","78","10039","10042","10.1039/d1cc03673d","","","0.71073","MoKα","","0.0908","0.0637","","","0.1554","0.1711","","","","","","1.03","","","","has coordinates","269604","2021-10-06","13:42:16",""
"7128937","14.6958","0.0008","13.8722","0.0007","12.7246","0.0006","90","","112.646","0.002","90","","2394.1","0.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H35 Cl N4 Pt -","- C22 H35 Cl N4 Pt -","- C88 H140 Cl4 N16 Pt4 -","4","1","","He, Fengkai; Gourlaouen, Christophe; Pang, Huan; Braunstein, Pierre","Imidazolium salts and [Pt(cod)<sub>2</sub>]: from NHC hydrido complexes to the unprecedented olefinic tetrahedral cluster [Pt<sub>4</sub>(μ-H)(cod)<sub>4</sub>]BF<sub>4</sub>.","Chemical communications (Cambridge, England)","2021","57","78","10039","10042","10.1039/d1cc03673d","","","0.71073","MoKα","","0.0276","0.0204","","","0.0358","0.0386","","","","","","1.069","","","","has coordinates","269604","2021-10-06","13:42:16",""
"7128938","35.5582","0.0006","28.7216","0.0005","15.5658","0.0004","90","","90","","90","","15897.2","0.6","100.01","0.1","100.01","0.1","","","","","","","","5","F d d 2","F 2 -2d","43","","(C16H72N2)WS4","","- C32 H72 N2 S4 W -","- C32 H72 N2 S4 W -","- C512 H1152 N32 S64 W16 -","16","1","","Thomas, Shibin; Greenacre, Victoria K.; Smith, Danielle E.; Noori, Yasir J.; Abdelazim, Nema M.; Hector, Andrew L.; de Groot, C. H. Kees; Levason, William; Bartlett, Philip N.; Reid, Gillian","Tungsten disulfide thin films <i>via</i> electrodeposition from a single source precursor.","Chemical communications (Cambridge, England)","2021","57","79","10194","10197","10.1039/d1cc03297f","","x-ray","0.71073","MoKα","","0.0623","0.0572","","","0.1408","0.1446","","","","","","1.054","","","","has coordinates","270365","2021-11-06","18:49:25",""
"7128939","20.3851","0.001","12.4673","0.0005","8.0484","0.0004","90","","92.394","0.003","90","","2043.69","0.16","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H18 F3 N O4 S -","- C23 H18 F3 N O4 S -","- C92 H72 F12 N4 O16 S4 -","4","1","","Vygranenko, Kateryna V.; Poronik, Yevgen M.; Wrzosek, Antoni; Szewczyk, Adam; Gryko, Daniel T.","Red emissive sulfone-rhodols as mitochondrial imaging agents.","Chemical communications (Cambridge, England)","2021","57","63","7782","7785","10.1039/d1cc02687a","","","1.54178","CuKα","","0.1516","0.0673","","","0.1486","0.1728","","","","","","1.023","","","","has coordinates","268481","2021-09-04","12:42:58",""
"7128940","10.0555","0.0004","11.6803","0.0005","18.1925","0.0007","90","","100.954","0.0018","90","","2097.8","0.15","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","","3-([1,1'-biphenyl]-2-yl)-4-methyl-2-(phenylthio)quinoline","","- C28 H21 N S -","- C28 H21 N S -","- C112 H84 N4 S4 -","4","2","","Cardenas, Mariel M.; Saputra, Mirza A.; Gordon, Deane A.; Sanchez, Andrea N.; Yamamoto, Nobuyuki; Gustafson, Jeffrey L.","Catalytic atroposelective dynamic kinetic resolutions and kinetic resolutions towards 3-arylquinolines <i>via</i> S<sub>N</sub>Ar.","Chemical communications (Cambridge, England)","2021","57","78","10087","10090","10.1039/d1cc04335h","","","0.71073","MoKα","","0.0381","0.0373","","","0.0916","0.0922","","","","","","1.171","","","","has coordinates","269601","2021-10-06","13:41:21",""
"7128941","9.8999","0.0002","13.7881","0.0003","27.3121","0.0006","90","","90","","90","","3728.12","0.14","100","","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-(2-fluoro-5-(trifluoromethyl)phenyl)-4-methyl-2-(phenylthio)quinoline","","- C23 H15 F4 N S -","- C23 H15 F4 N S -","- C184 H120 F32 N8 S8 -","8","2","","Cardenas, Mariel M.; Saputra, Mirza A.; Gordon, Deane A.; Sanchez, Andrea N.; Yamamoto, Nobuyuki; Gustafson, Jeffrey L.","Catalytic atroposelective dynamic kinetic resolutions and kinetic resolutions towards 3-arylquinolines <i>via</i> S<sub>N</sub>Ar.","Chemical communications (Cambridge, England)","2021","57","78","10087","10090","10.1039/d1cc04335h","","","0.71073","MoKα","","0.0226","0.0223","","","0.0591","0.0594","","","","","","1.058","","","","has coordinates,has disorder","269601","2021-10-06","13:41:21",""
"7128942","16.0974","0.001","11.1555","0.0008","17.8712","0.0011","90","","90","","90","","3209.2","0.4","298","2","298.15","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C15 H12 Cl N3 O2 S -","- C15 H12 Cl N3 O2 S -","- C120 H96 Cl8 N24 O16 S8 -","8","1","","Zheng, Long; Wang, Zhanjing; Li, Chen; Wu, Yong; Liu, Zhaohong; Ning, Yongquan","The azidosulfonylation of terminal alkynes leading to β-azidovinyl sulfones.","Chemical communications (Cambridge, England)","2021","57","77","9874","9877","10.1039/d1cc04268h","","","0.71073","MoKα","","0.126","0.0592","","","0.131","0.1603","","","","","","1.049","","","","has coordinates","269628","2021-10-06","13:50:23",""
"7128943","9.4348","0.0004","10.8834","0.0005","24.5503","0.0009","90","","90","","90","","2520.89","0.18","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H24 N4 O2 -","- C31 H24 N4 O2 -","- C124 H96 N16 O8 -","4","1","","Yan, Hang; Jia, Shi-Kun; Geng, Yu-Huan; Han, Jiao-Jiao; Hua, Yuan-Zhao; Wang, Min-Can","Dinuclear zinc-catalyzed asymmetric Friedel-Crafts alkylation/cyclization of 3-aminophenols with α,α-dicyanoolefins.","Chemical communications (Cambridge, England)","2021","57","77","9854","9857","10.1039/d1cc04177k","","","1.54184","CuKα","","0.0472","0.0404","","","0.0993","0.1049","","","","","","1.053","","","","has coordinates","269621","2021-10-06","13:48:31",""
"7128944","17.401","0.008","5.9984","0.0013","18.889","0.006","90","","115.06","0.05","90","","1786","1.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H15 Br O5 -","- C19 H15 Br O5 -","- C76 H60 Br4 O20 -","4","2","","Dzieszkowski, Krzysztof; Słotwiński, Michał; Rafińska, Katarzyna; Muzioł, Tadeusz M; Rafiński, Zbigniew","NHC-catalyzed enantioselective C2-functionalization of 3-hydroxychromenones <i>via</i> α,β-unsaturated acyl azoliums.","Chemical communications (Cambridge, England)","2021","57","78","9999","10002","10.1039/d1cc03708k","","x-ray","0.71073","MoKα","","0.1233","0.0551","","","0.1122","0.1451","","","","","","1.004","","","","has coordinates,has disorder","269602","2021-10-06","13:41:30",""
"7128945","6.995","0.005","8.942","0.006","9.23","0.006","69.122","0.005","89.652","0.006","83.064","0.006","535.1","0.6","180","2","179.98","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H13 B2 N -","- C12 H13 B2 N -","- C24 H26 B4 N2 -","2","1","","Dong, Jiaqi; Zhang, Lutao; Tan, Dehui; Wu, Jianfeng; Wang, Nan; Mellerup, Soren K.; Wang, Suning; Yang, Deng-Tao","Formation of an air-stable diborane <i>via</i> a stepwise BH<sub>3</sub> addition of pyrido[1,2-<i>a</i>]isoindole with H<sub>2</sub> evolution.","Chemical communications (Cambridge, England)","2021","57","77","9882","9885","10.1039/d1cc04228a","","","0.71073","MoKα","","0.0964","0.0562","","","0.1147","0.1351","","","","","","1.075","","","","has coordinates","269627","2021-10-06","13:50:15",""
"7128946","14.8879","0.0004","16.0972","0.0004","19.9238","0.0006","79.1823","0.0016","80.6461","0.0016","65.3053","0.0014","4242.1","0.2","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C128 H70 N2 O2 P2 Pt -","- C128 H70 N2 O2 P2 Pt -","- C256 H140 N4 O4 P4 Pt2 -","2","1","","Gralinski, Steven R.; Roy, Mrittika; Baldauf, Lilia M.; Olmstead, Marilyn M.; Balch, Alan L.","Introduction of a (Ph<sub>3</sub>P)<sub>2</sub>Pt group into the rim of an open-cage fullerene by breaking a carbon-carbon bond.","Chemical communications (Cambridge, England)","2021","57","79","10218","10221","10.1039/d1cc04336f","","","0.71073","MoKα","","0.0899","0.0733","","","0.172","0.1827","","","","","","1.161","","","","has coordinates,has disorder","270366","2021-11-06","18:49:35",""
"7128947","14.7186","0.0012","16.4565","0.0014","19.6359","0.0016","79.689","0.002","81.529","0.002","65.546","0.002","4245.3","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C134 H62 N2 O2 P2 Pt -","- C134 H62 N2 O2 P2 Pt -","- C268 H124 N4 O4 P4 Pt2 -","2","1","","Gralinski, Steven R.; Roy, Mrittika; Baldauf, Lilia M.; Olmstead, Marilyn M.; Balch, Alan L.","Introduction of a (Ph<sub>3</sub>P)<sub>2</sub>Pt group into the rim of an open-cage fullerene by breaking a carbon-carbon bond.","Chemical communications (Cambridge, England)","2021","57","79","10218","10221","10.1039/d1cc04336f","","","0.71073","MoKα","","0.094","0.0582","","","0.1342","0.1451","","","","","","1.101","","","","has coordinates,has disorder","270366","2021-11-06","18:49:36",""
"7128948","10.7992","0.0006","10.9972","0.0005","11.7181","0.0007","93.977","0.004","106.212","0.005","112.74","0.005","1207.49","0.13","113.15","","113.15","","","","","","","","","4","P -1","-P 1","2","","","","- C27 H29 N O7 -","- C27 H29 N O7 -","- C54 H58 N2 O14 -","2","1","","Li, Xiaohu; Huang, You","Phosphine-catalyzed sequential (2+3)/(2+4) annulation of γ-vinyl allenoates: access to the synthesis of chromeno[4,3-<i>b</i>]pyrroles.","Chemical communications (Cambridge, England)","2021","57","77","9934","9937","10.1039/d1cc04199a","","x-ray","0.71073","MoKα","","0.0664","0.0472","","","0.1073","0.1182","","","","","","1.038","","","","has coordinates","269625","2021-10-06","13:49:53",""
"7128949","8.5865","0.0002","14.3767","0.0004","15.4328","0.0003","90","","98.973","0.001","90","","1881.8","0.08","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H18 N2 O2 S -","- C23 H18 N2 O2 S -","- C92 H72 N8 O8 S4 -","4","1","","Wan, Jin-Lin; Cui, Jian-Feng; Zhong, Wei-Qiang; Huang, Jing-Mei","Iminyl-radicals by electrochemical decarboxylation of α-imino-oxy acids: construction of indole-fused polycyclics.","Chemical communications (Cambridge, England)","2021","57","79","10242","10245","10.1039/d1cc03891e","","","0.71073","MoKα","","0.043","0.036","","","0.0893","0.0954","","","","","","1.04","","","","has coordinates","270364","2021-11-06","18:49:13",""
"7128950","3.9127","0.0001","28.5829","0.0008","10.3664","0.0003","90","","92.863","0.001","90","","1157.89","0.06","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 N O -","- C16 H11 N O -","- C64 H44 N4 O4 -","4","1","","Shen, Xiao-Qin; Yan, Xiao-Wei; Zhang, Xing-Guo","A palladium-catalyzed ring-expansion reaction of cyclobutanols with 2-haloanilines leading to benzazepines and quinolines.","Chemical communications (Cambridge, England)","2021","57","79","10234","10237","10.1039/d1cc04395a","","","0.71073","MoKα","","0.0432","0.036","","","0.0885","0.094","","","","","","1.05","","","","has coordinates","270368","2021-11-06","18:50:18",""
"7128951","19.0123","0.0005","19.0123","0.0005","12.4699","0.0004","90","","90","","120","","3903.58","0.19","100","2","100","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C114 H150 Mn6 N54 O30 W3 -","- C114 H150 Mn6 N54 O30 W3 -","- C114 H150 Mn6 N54 O30 W3 -","1","0.166667","","Magott, Michał; Pinkowicz, Dawid","Chiral porous CN-bridged coordination polymer mimicking MOF-74 and showing magnetization photoswitching.","Chemical communications (Cambridge, England)","2021","57","77","9926","9929","10.1039/d1cc03870b","","","0.71073","MoKα","","0.0708","0.0534","","","0.1053","0.1125","","","","","","1.039","","","","has coordinates","269624","2021-10-06","13:49:31",""
"7128952","18.6385","0.0004","18.6385","0.0004","12.3021","0.0003","90","","90","","120","","3701.11","0.14","30","2","30","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C22.8 H30 Mn1.2 N10.8 W0.6 -","- C22.8 H30 Mn1.2 N10.8 W0.6 -","- C114 H150 Mn6 N54 W3 -","5","0.833333","","Magott, Michał; Pinkowicz, Dawid","Chiral porous CN-bridged coordination polymer mimicking MOF-74 and showing magnetization photoswitching.","Chemical communications (Cambridge, England)","2021","57","77","9926","9929","10.1039/d1cc03870b","","","0.6889","synchrotron","","0.0774","0.0629","","","0.1657","0.1762","","","","","","1.059","","","","has coordinates,has disorder","269624","2021-10-06","13:49:33",""
"7128953","19.0231","0.0005","19.0231","0.0005","12.4374","0.0004","90","","90","","120","","3897.83","0.19","100","2","100","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C114 H150 Mn6 N54 O30 W3 -","- C114 H150 Mn6 N54 O30 W3 -","- C114 H150 Mn6 N54 O30 W3 -","1","0.166667","","Magott, Michał; Pinkowicz, Dawid","Chiral porous CN-bridged coordination polymer mimicking MOF-74 and showing magnetization photoswitching.","Chemical communications (Cambridge, England)","2021","57","77","9926","9929","10.1039/d1cc03870b","","","0.71073","MoKα","","0.0436","0.0403","","","0.0911","0.0929","","","","","","1.083","","","","has coordinates","269624","2021-10-06","13:49:33",""
"7128954","22.4855","0.001","22.5246","0.0009","25.9711","0.0013","65.278","0.005","69.004","0.004","67.104","0.004","10701.9","1","140","0.1","140","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C360 H278 B8 N24 Pd6 S12 -","- C360 H278 B8 N24 Pd6 S12 -","- C360 H278 B8 N24 Pd6 S12 -","1","0.5","","Li, Ru-Jin; Marcus, Adam; Fadaei-Tirani, Farzaneh; Severin, Kay","Orientational self-sorting: formation of structurally defined Pd<sub>4</sub>L<sub>8</sub> and Pd<sub>6</sub>L<sub>12</sub> cages from low-symmetry dipyridyl ligands.","Chemical communications (Cambridge, England)","2021","57","78","10023","10026","10.1039/d1cc03828a","","x-ray","1.54184","CuKα","","0.2797","0.2192","","","0.5045","0.5476","","","","","","1.899","","","","has coordinates","269600","2021-10-06","13:41:05",""
"7128955","30.152","0.0005","39.3021","0.001","33.998","0.0006","90","","90","","90","","40288.9","1.4","140","0.1","140","0.1","","","","","","","","7","C c c a :2","-C 2a 2ac","68","","","","- C176 H136 B9 F28 N16 Na Pd4 -","- C176 H136 B9 F28 N16 Na Pd4 -","- C1408 H1088 B72 F224 N128 Na8 Pd32 -","8","0.5","","Li, Ru-Jin; Marcus, Adam; Fadaei-Tirani, Farzaneh; Severin, Kay","Orientational self-sorting: formation of structurally defined Pd<sub>4</sub>L<sub>8</sub> and Pd<sub>6</sub>L<sub>12</sub> cages from low-symmetry dipyridyl ligands.","Chemical communications (Cambridge, England)","2021","57","78","10023","10026","10.1039/d1cc03828a","","x-ray","1.54184","CuKα","","0.128","0.0985","","","0.2831","0.3227","","","","","","1.032","","","","has coordinates,has disorder","269600","2021-10-06","13:41:09",""
"7128956","8.4801","0.0013","8.4744","0.0013","10.9285","0.0017","105.368","0.005","101.641","0.006","94.3","0.006","734.8","0.2","193","2","193","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H22 Na2 O27 V6 -","- C10 H22 Na2 O27 V6 -","- C10 H22 Na2 O27 V6 -","1","0.5","","Wu, Pingfan; Li, Jincheng; Xiao, Zicheng; Zhao, Yanchao; Wang, Yu; Xiao, Bowen; Huang, Bo","Ir-based electrocatalysts promoted by TME-substituted polyoxovanadate-derived vanadium carbide for efficient hydrogen evolution and oxygen evolution.","Chemical communications (Cambridge, England)","2021","57","80","10395","10398","10.1039/d1cc03559b","","","1.34138","GaKα","","0.0537","0.0502","","","0.1449","0.1486","","","","","","1.122","","","","has coordinates","270376","2021-11-06","18:52:36",""
"7128957","6.6813","0.0007","9.1526","0.0009","12.8079","0.0013","71.835","0.008","78.233","0.009","71.616","0.008","701.34","0.13","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H13 N3 O6 -","- C16 H13 N3 O6 -","- C32 H26 N6 O12 -","2","1","","Yan, Yong; Henfling, Stefan; Zhang, Ning-Ning; Krautscheid, Harald","Semiconductive coordination polymers with continuous π-π interactions and defined crystal structures.","Chemical communications (Cambridge, England)","2021","57","80","10407","10410","10.1039/d1cc03333f","","","1.54186","CuKα","","0.087","0.06","","","0.1456","0.1575","","","","","","1.021","","","","has coordinates","270372","2021-11-06","18:51:42",""
"7128958","12.2948","0.0008","6.545","0.0003","16.9823","0.0009","90","","104.89","0.005","90","","1320.67","0.13","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H8 N2 O8 Sr -","- C14 H8 N2 O8 Sr -","- C56 H32 N8 O32 Sr4 -","4","1","","Yan, Yong; Henfling, Stefan; Zhang, Ning-Ning; Krautscheid, Harald","Semiconductive coordination polymers with continuous π-π interactions and defined crystal structures.","Chemical communications (Cambridge, England)","2021","57","80","10407","10410","10.1039/d1cc03333f","","","1.54186","CuKα","","0.0666","0.0547","","","0.1495","0.1592","","","","","","1.071","","","","has coordinates,has disorder","270372","2021-11-06","18:51:42",""
"7128959","7.4711","0.0003","8.7536","0.0004","14.0801","0.0007","78.791","0.004","82.589","0.004","67.238","0.003","831.44","0.07","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H15 N3 O7 -","- C18 H15 N3 O7 -","- C36 H30 N6 O14 -","2","1","","Yan, Yong; Henfling, Stefan; Zhang, Ning-Ning; Krautscheid, Harald","Semiconductive coordination polymers with continuous π-π interactions and defined crystal structures.","Chemical communications (Cambridge, England)","2021","57","80","10407","10410","10.1039/d1cc03333f","","","1.54186","CuKα","","0.1151","0.0759","","","0.2285","0.2537","","","","","","0.975","","","","has coordinates","270372","2021-11-06","18:51:42",""
"7128960","12.1377","0.0013","6.412","0.0005","16.7906","0.0016","90","","105.11","0.008","90","","1261.6","0.2","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H8 Ca N2 O8 -","- C14 H8 Ca N2 O8 -","- C56 H32 Ca4 N8 O32 -","4","1","","Yan, Yong; Henfling, Stefan; Zhang, Ning-Ning; Krautscheid, Harald","Semiconductive coordination polymers with continuous π-π interactions and defined crystal structures.","Chemical communications (Cambridge, England)","2021","57","80","10407","10410","10.1039/d1cc03333f","","","1.54186","CuKα","","0.0436","0.0338","","","0.0878","0.0935","","","","","","1.086","","","","has coordinates","270372","2021-11-06","18:51:42",""
"7128961","24.7024","0.0015","33.182","0.002","38.8512","0.0018","102.791","0.003","103.733","0.002","90.602","0.003","30100","3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C149 H301 Ag71 F12 P2 S31 Sb2 -","- C149 H301 Ag71 F12 P2 S31 Sb2 -","- C596 H1204 Ag284 F48 P8 S124 Sb8 -","4","2","","Zhou, Manman; Bao, Yizheng; Jin, Shan; Wen, Shuaishuai; Chen, Shuang; Zhu, Manzhou","[Ag<sub>71</sub>(S-<sup><i>t</i></sup>Bu)<sub>31</sub>(Dppm)](SbF<sub>6</sub>)<sub>2</sub>: an intermediate-sized metalloid silver nanocluster containing a building block of Ag<sub>64</sub>.","Chemical communications (Cambridge, England)","2021","57","80","10383","10386","10.1039/d1cc04934h","","","1.54186","CuKα","","0.0676","0.0458","","","0.0805","0.0941","","","","","","1.079","","","","has coordinates","270371","2021-11-06","18:51:32",""
"7128966","9.7754","0.0003","16.4149","0.0005","9.7376","0.0003","90","","102.26","0.003","90","","1526.88","0.08","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","di-tert-butyl 1-(trifluoromethyl)hydrazine-1,2-dicarboxylate","","- C11 H19 F3 N2 O4 -","- C11 H19 F3 N2 O4 -","- C44 H76 F12 N8 O16 -","4","1","","Cao, Tingting; Retailleau, Pascal; Milcent, Thierry; Crousse, Benoît","Synthesis of <i>N</i>-CF<sub>3</sub> hydrazines through radical trifluoromethylation of azodicarboxylates.","Chemical communications (Cambridge, England)","2021","57","80","10351","10354","10.1039/d1cc04538e","","","0.71073","MoKα","","0.0445","0.0373","","","0.0923","0.0961","","","","","","1.05","","","","has coordinates","270370","2021-11-06","18:51:12",""
"7128967","4.977","0.0003","7.7308","0.0006","11.6315","0.0012","90","","90.771","0.007","90","","447.5","0.06","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","'(S)-1-oxo-1-(2-(trifluoromethyl)hydrazineyl)propan-2-aminium chloride'","","- C4 H9 Cl F3 N3 O -","- C4 H9 Cl F3 N3 O -","- C8 H18 Cl2 F6 N6 O2 -","2","1","","Cao, Tingting; Retailleau, Pascal; Milcent, Thierry; Crousse, Benoît","Synthesis of <i>N</i>-CF<sub>3</sub> hydrazines through radical trifluoromethylation of azodicarboxylates.","Chemical communications (Cambridge, England)","2021","57","80","10351","10354","10.1039/d1cc04538e","","","0.71073","MoKα","","0.0508","0.0389","","","0.0894","0.0953","","","","","","1.025","","","","has coordinates","270370","2021-11-06","18:51:12",""
"7128968","5.128","0.003","27.296","0.013","15.794","0.009","90","","95.556","0.012","90","","2200","2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","'benzyl (S)-(1-oxo-1-(1-(trifluoromethyl)hydrazineyl)propan-2-yl)carbamate'","","- C12 H14.67 F3 N3 O3.33 -","- C12 H14.6667 F3 N3 O3.33333 -","- C72 H88 F18 N18 O20 -","6","3","","Cao, Tingting; Retailleau, Pascal; Milcent, Thierry; Crousse, Benoît","Synthesis of <i>N</i>-CF<sub>3</sub> hydrazines through radical trifluoromethylation of azodicarboxylates.","Chemical communications (Cambridge, England)","2021","57","80","10351","10354","10.1039/d1cc04538e","","","1.54187","CuKα","","0.1368","0.0891","","","0.2072","0.2454","","","","","","0.923","","","","has coordinates","270370","2021-11-06","18:51:12",""
"7128969","15.984","0.0009","12.2827","0.0007","10.0356","0.0005","90","","94.87","0.002","90","","1963.14","0.19","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H28 N2 O2 -","- C22 H28 N2 O2 -","- C88 H112 N8 O8 -","4","1","","Giri, Chandan Kumar; Dana, Suman; Baidya, Mahiuddin","Ruthenium(II)-catalyzed C-H activation and (4+2) annulation of aromatic hydroxamic acid esters with allylic amides.","Chemical communications (Cambridge, England)","2021","57","81","10536","10539","10.1039/d1cc04422b","","","0.71073","MoKα","","0.0776","0.0592","","","0.1564","0.1841","","","","","","1.109","","","","has coordinates","270358","2021-11-06","18:47:07",""
"7128970","16.1915","0.0004","16.1915","0.0004","4.0757","0.0001","90","","90","","90","","1068.5","0.05","1.85","","1.85","","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C7 H5 Cl N3 Se4 -","- C7 H5 Cl N3 Se4 -","- C28 H20 Cl4 N12 Se16 -","4","0.5","","Robertson, Craig M.; Winter, Stephen M.; Howard, Judith A. K.; Probert, Michael R.; Oakley, Richard T.","Low temperature insights into the crystal and magnetic structure of a neutral radical ferromagnet.","Chemical communications (Cambridge, England)","2021","57","79","10238","10241","10.1039/d1cc03842g","","","0.71073","MoKα","","0.0358","0.0252","","","0.0408","0.0431","","","","","","1.049","","","","has coordinates","270360","2021-11-06","18:48:08",""
"7128971","7.3621","0.0003","16.4766","0.0007","11.3205","0.0005","90","","93.878","0.002","90","","1370.06","0.1","296","2","296.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H34 B2 S2 -","- C30 H34 B2 S2 -","- C60 H68 B4 S4 -","2","0.5","","Sa, Shreenibasa; Murali, Anna Chandrasekar; Nayak, Prakash; Venkatasubbaiah, Krishnan","Thiophene-fused boracycles as photoactive analogues of diboraanthracenes.","Chemical communications (Cambridge, England)","2021","57","79","10170","10173","10.1039/d1cc03323a","","","0.71073","MoKα","","0.061","0.0467","","","0.1309","0.1429","","","","","","1.022","","","","has coordinates","270361","2021-11-06","18:48:16",""
"7128972","10.54815","0.00016","14.5492","0.0002","8.34333","0.00015","90","","97.4946","0.0016","90","","1269.49","0.03","297.6","0.8","297.6","0.8","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 B2 S2 -","- C28 H30 B2 S2 -","- C56 H60 B4 S4 -","2","0.5","","Sa, Shreenibasa; Murali, Anna Chandrasekar; Nayak, Prakash; Venkatasubbaiah, Krishnan","Thiophene-fused boracycles as photoactive analogues of diboraanthracenes.","Chemical communications (Cambridge, England)","2021","57","79","10170","10173","10.1039/d1cc03323a","","x-ray","1.54184","CuKα","","0.0749","0.068","","","0.1955","0.203","","","","","","1.112","","","","has coordinates","270361","2021-11-06","18:48:16",""
"7128973","8.24253","0.00009","10.98466","0.00011","12.92511","0.00013","111.405","0.001","93.4027","0.0008","104.902","0.0009","1037.52","0.02","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H27 N O7 -","- C23 H27 N O7 -","- C46 H54 N2 O14 -","2","1","","Bhat, Aabid; Tucker, Nathan; Lin, Jian-Bin; Grover, Huck","Stereoselective copper-catalyzed heteroarene C-H functionalization/Michael-type annulation cascade with α-diazocarbonyls.","Chemical communications (Cambridge, England)","2021","57","81","10556","10559","10.1039/d1cc04590c","","x-ray","1.54184","CuKα","","0.0333","0.0324","","","0.0818","0.0825","","","","","","1.037","","","","has coordinates","270359","2021-11-06","18:47:22",""
"7128974","8.1806","0.0003","11.5207","0.0003","12.2742","0.0002","70.006","0.002","77.003","0.002","88.377","0.003","1057.73","0.05","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H25 N O7 -","- C22 H25 N O7 -","- C44 H50 N2 O14 -","2","1","","Bhat, Aabid; Tucker, Nathan; Lin, Jian-Bin; Grover, Huck","Stereoselective copper-catalyzed heteroarene C-H functionalization/Michael-type annulation cascade with α-diazocarbonyls.","Chemical communications (Cambridge, England)","2021","57","81","10556","10559","10.1039/d1cc04590c","","x-ray","1.54184","CuKα","","0.0434","0.0402","","","0.1089","0.1122","","","","","","1.079","","","","has coordinates,has disorder","270359","2021-11-06","18:47:25",""
"7128975","13.27378","0.00013","17.12971","0.00015","9.945","0.00009","90","","104.315","0.001","90","","2191.04","0.04","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H27 N O7 -","- C23 H27 N O7 -","- C92 H108 N4 O28 -","4","1","","Bhat, Aabid; Tucker, Nathan; Lin, Jian-Bin; Grover, Huck","Stereoselective copper-catalyzed heteroarene C-H functionalization/Michael-type annulation cascade with α-diazocarbonyls.","Chemical communications (Cambridge, England)","2021","57","81","10556","10559","10.1039/d1cc04590c","","x-ray","1.54184","CuKα","","0.0461","0.0402","","","0.1027","0.1069","","","","","","1.06","","","","has coordinates","270359","2021-11-06","18:47:25",""
"7128976","9.2549","0.0005","10.9358","0.0004","11.8353","0.0005","70.812","0.004","83.459","0.004","69.525","0.004","1059.83","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H25 N O5 -","- C25 H25 N O5 -","- C50 H50 N2 O10 -","2","1","","Bhat, Aabid; Tucker, Nathan; Lin, Jian-Bin; Grover, Huck","Stereoselective copper-catalyzed heteroarene C-H functionalization/Michael-type annulation cascade with α-diazocarbonyls.","Chemical communications (Cambridge, England)","2021","57","81","10556","10559","10.1039/d1cc04590c","","x-ray","1.54184","CuKα","","0.0504","0.0436","","","0.1161","0.1217","","","","","","1.074","","","","has coordinates","270359","2021-11-06","18:47:25",""
"7128977","13.7019","0.0013","13.9995","0.0012","21.143","0.002","74.258","0.005","79.162","0.005","63.495","0.004","3482.7","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Zn-TDA","","- C62 H52 N10 O15 Zn3 -","- C62 H52 N10 O15 Zn3 -","- C124 H104 N20 O30 Zn6 -","2","1","","Li, Yang; Tian, Xueqin; Jiang, Weiwei; Wu, Pengyan; Li, Han-Shu; Wang, Man; Lin, Chen; Wang, Jian","Amino and triazole-containing metal-organic frameworks for highly efficient CO<sub>2</sub> fixation.","Chemical communications (Cambridge, England)","2021","57","82","10803","10806","10.1039/d1cc04371d","","","0.71073","MoKα","","0.0674","0.0443","","","0.1201","0.1276","","","","","","1.026","","","","has coordinates","270401","2021-11-06","19:00:24",""
"7128978","11.3536","0.0008","9.6592","0.0007","16.8001","0.0012","90","","107.174","0.003","90","","1760.3","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","cs1av_2l","","","- C18 H18 Br N O3 S -","- C18 H18 Br N O3 S -","- C72 H72 Br4 N4 O12 S4 -","4","1","","Velasco-Rubio, Álvaro; Varela, Jesús A; Saá, Carlos","Pd-Catalyzed allylic C-H activation to seven-membered <i>N</i>,<i>O</i>-heterocycles.","Chemical communications (Cambridge, England)","2021","57","83","10915","10918","10.1039/d1cc04056a","","","0.71073","MoKα","","0.0724","0.0615","","","0.1499","0.1572","","","","","","1.07","","","","has coordinates","270354","2021-11-06","18:46:25",""
"7128979","9.3804","0.0008","23.7391","0.0019","9.4372","0.0007","90","","114.324","0.003","90","","1914.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","cs1av_2o","","","- C20 H23 N O5 S -","- C20 H23 N O5 S -","- C80 H92 N4 O20 S4 -","4","1","","Velasco-Rubio, Álvaro; Varela, Jesús A; Saá, Carlos","Pd-Catalyzed allylic C-H activation to seven-membered <i>N</i>,<i>O</i>-heterocycles.","Chemical communications (Cambridge, England)","2021","57","83","10915","10918","10.1039/d1cc04056a","","","0.71073","MoKα","","0.1384","0.1292","","","0.2387","0.2431","","","","","","1.243","","","","has coordinates,has disorder","270354","2021-11-06","18:46:26",""
"7128989","29.5276","0.0011","29.5276","0.0011","6.0515","0.0003","90","","90","","90","","5276.2","0.4","100","0.2","100","0.2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H13 N O S -","- C16 H13 N O S -","- C256 H208 N16 O16 S16 -","16","1","","Fu, Yuanyuan; Zhao, Xueyan; Chen, Dengfeng; Luo, Jinyue; Huang, Shenlin","Cu-catalyzed coupling of indanone oxime acetates with thiols to 2,3-difunctionalized indenones.","Chemical communications (Cambridge, England)","2021","57","82","10719","10722","10.1039/d1cc04167c","","x-ray","1.54184","CuKα","","0.0551","0.0513","","","0.1333","0.1394","","","","","","1.058","","","","has coordinates","270404","2021-11-06","19:02:21",""
"7128990","14.9422","0.0017","14.9487","0.0017","13.7186","0.0016","90","","90","","90","","3064.3","0.6","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C15 H15 N3 Ni O4 S -","- C15 H15 N3 Ni O4 S -","- C120 H120 N24 Ni8 O32 S8 -","8","1","","Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier","Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes.","Chemical communications (Cambridge, England)","2021","57","80","10403","10406","10.1039/d1cc03077a","","","0.71073","MoKα","","0.0323","0.0278","","","0.0651","0.0665","","","","","","1.05","","","","has coordinates,has disorder","270375","2021-11-06","18:52:23",""
"7128991","11.9552","0.0009","12.176","0.0009","12.797","0.0009","98.838","0.004","112.789","0.004","108.273","0.004","1548.2","0.2","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H16 N3 Ni O3.5 S -","- C15 H16 N3 Ni O3.5 S -","- C60 H64 N12 Ni4 O14 S4 -","4","2","","Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier","Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes.","Chemical communications (Cambridge, England)","2021","57","80","10403","10406","10.1039/d1cc03077a","","","1.54178","CuKα","","0.0461","0.0375","","","0.0914","0.0953","","","","","","1.097","","","","has coordinates","270375","2021-11-06","18:52:25",""
"7128992","10.967","0.002","14.103","0.003","21.624","0.004","90","","104.421","0.002","90","","3239.2","1.1","112","2","112","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C31 H30 Cl2 Cu N6 O7 S2 -","- C31 H30 Cl2 Cu N6 O7 S2 -","- C124 H120 Cl8 Cu4 N24 O28 S8 -","4","1","","Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier","Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes.","Chemical communications (Cambridge, England)","2021","57","80","10403","10406","10.1039/d1cc03077a","","","0.71073","MoKα","","0.0531","0.0386","","","0.0878","0.0942","","","","","","1.051","","","","has coordinates,has disorder","270375","2021-11-06","18:52:25",""
"7128993","18.1906","0.0003","12.7306","0.0002","10.9264","0.0002","90","","100.539","0.001","90","","2487.62","0.07","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H31 Cu N3 O4 S -","- C23 H31 Cu N3 O4 S -","- C92 H124 Cu4 N12 O16 S4 -","4","1","","Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier","Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes.","Chemical communications (Cambridge, England)","2021","57","80","10403","10406","10.1039/d1cc03077a","","","1.54178","CuKα","","0.0636","0.0435","","","0.1197","0.1342","","","","","","1.103","","","","has coordinates","270375","2021-11-06","18:52:25",""
"7128994","11.2868","0.0012","9.656","0.001","14.3063","0.0015","90","","94.472","0.001","90","","1554.4","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H30 Cu2 N6 O8 S2 -","- C30 H30 Cu2 N6 O8 S2 -","- C60 H60 Cu4 N12 O16 S4 -","2","0.5","","Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier","Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes.","Chemical communications (Cambridge, England)","2021","57","80","10403","10406","10.1039/d1cc03077a","","","0.71073","MoKα","","0.0451","0.0328","","","0.0736","0.0787","","","","","","1.051","","","","has coordinates","270375","2021-11-06","18:52:25",""
"7128995","16.4967","0.0019","12.7673","0.0015","11.5945","0.0014","90","","107.073","0.002","90","","2334.4","0.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H31 N3 Ni O4 S -","- C23 H31 N3 Ni O4 S -","- C92 H124 N12 Ni4 O16 S4 -","4","1","","Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier","Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes.","Chemical communications (Cambridge, England)","2021","57","80","10403","10406","10.1039/d1cc03077a","","","0.71073","MoKα","","0.0795","0.0627","","","0.154","0.1654","","","","","","1.019","","","","has coordinates","270375","2021-11-06","18:52:25",""
"7128996","15.0116","0.0007","15.0137","0.0009","13.9214","0.0008","90","","90","","90","","3137.6","0.3","300","2","300","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C15 H15 N3 O4 S Zn -","- C15 H15 N3 O4 S Zn -","- C120 H120 N24 O32 S8 Zn8 -","8","1","","Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier","Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes.","Chemical communications (Cambridge, England)","2021","57","80","10403","10406","10.1039/d1cc03077a","","","1.54178","CuKα","","0.0592","0.05","","","0.1329","0.1396","","","","","","1.074","","","","has coordinates,has disorder","270375","2021-11-06","18:52:25",""
"7128997","12.0902","0.0017","14.849","0.002","16.669","0.002","111.874","0.002","106.757","0.002","94.825","0.002","2596.7","0.6","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C24.62 H35 Cl0.25 N3 O4.38 S Zn -","- C24.625 H35 Cl0.25 N3 O4.375 S Zn -","- C98.5 H140 Cl N12 O17.5 S4 Zn4 -","4","2","","Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier","Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes.","Chemical communications (Cambridge, England)","2021","57","80","10403","10406","10.1039/d1cc03077a","","","0.71073","MoKα","","0.1229","0.0691","","","0.148","0.1659","","","","","","1.041","","","","has coordinates,has disorder","270375","2021-11-06","18:52:25",""
"7128998","19.5284","0.001","7.3377","0.0004","34.2044","0.0017","90","","90","","90","","4901.3","0.4","110","2","110","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C23 H31 N3 O5 S -","- C23 H31 N3 O5 S -","- C184 H248 N24 O40 S8 -","8","1","","Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier","Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes.","Chemical communications (Cambridge, England)","2021","57","80","10403","10406","10.1039/d1cc03077a","","","1.54178","CuKα","","0.0527","0.046","","","0.1212","0.1246","","","","","","1.108","","","","has coordinates","270375","2021-11-06","18:52:25",""
"7128999","16.3521","0.0012","12.6368","0.0009","11.7356","0.0009","90","","106.319","0.004","90","","2327.3","0.3","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H29 N3 Ni O4 S -","- C23 H29 N3 Ni O4 S -","- C92 H116 N12 Ni4 O16 S4 -","4","1","","Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier","Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes.","Chemical communications (Cambridge, England)","2021","57","80","10403","10406","10.1039/d1cc03077a","","","1.54178","CuKα","","0.0401","0.0349","","","0.0907","0.0944","","","","","","1.027","","","","has coordinates","270375","2021-11-06","18:52:25",""
"7129000","3.57206","0.00002","3.57206","0.00002","12.19453","0.0001","90","","90","","90","","155.598","0.0018","297","2","297","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ca2 N2 Ni -","- Ca2 N2 Ni -","- Ca4 N4 Ni2 -","2","0.0625","","Kloß, Simon D; Attfield, J. Paul","Low-dimensional magnetism in calcium nitridonickelate(II) Ca<sub>2</sub>NiN<sub>2</sub>.","Chemical communications (Cambridge, England)","2021","57","80","10427","10430","10.1039/d1cc04001d","powder diffraction","x-ray","1.5406","CuKα1","","","","","","","","","1.99","1.31","","","","","","","has coordinates","270374","2021-11-06","18:51:58",""
"7129001","7.252","0.0006","8.5655","0.0008","13.9821","0.0012","90","","90","","90","","868.53","0.13","100","","100","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C7 H5 Br F3 N O -","- C7 H5 Br F3 N O -","- C28 H20 Br4 F12 N4 O4 -","4","1","","Lauzon, Samuel; Ollevier, Thierry","2,2'-Bipyridine-α,α'-trifluoromethyl-diol ligand: synthesis and application in the asymmetric Et<sub>2</sub>Zn alkylation of aldehydes.","Chemical communications (Cambridge, England)","2021","57","84","11025","11028","10.1039/d1cc04556c","","x-ray","1.54178","CuKα","","0.0172","0.0172","","","0.0449","0.0449","","","","","","1.173","","","","has coordinates","270392","2021-11-06","18:56:38",""
"7129002","14.5873","0.0002","14.5873","0.0002","6.7844","0.0002","90","","90","","90","","1443.65","0.05","120","","120","","","","","","","","","5","P 42 21 2","P 4n 2n","94","","","","- C14 H10 F6 N2 O2 -","- C14 H10 F6 N2 O2 -","- C56 H40 F24 N8 O8 -","4","0.5","","Lauzon, Samuel; Ollevier, Thierry","2,2'-Bipyridine-α,α'-trifluoromethyl-diol ligand: synthesis and application in the asymmetric Et<sub>2</sub>Zn alkylation of aldehydes.","Chemical communications (Cambridge, England)","2021","57","84","11025","11028","10.1039/d1cc04556c","","x-ray","1.34139","GaKα","","0.0301","0.0299","","","0.0792","0.0794","","","","","","1.064","","","","has coordinates","270392","2021-11-06","18:56:39",""
"7129003","17.4342","0.0004","12.8734","0.0003","23.1114","0.0006","90","","93.993","0.001","90","","5174.5","0.2","100","","100","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C16 H14.08 F12 N2 O10.04 S2 Zn -","- C16 H14.08 F12 N2 O10.04 S2 Zn -","- C128 H112.64 F96 N16 O80.32 S16 Zn8 -","8","4","","Lauzon, Samuel; Ollevier, Thierry","2,2'-Bipyridine-α,α'-trifluoromethyl-diol ligand: synthesis and application in the asymmetric Et<sub>2</sub>Zn alkylation of aldehydes.","Chemical communications (Cambridge, England)","2021","57","84","11025","11028","10.1039/d1cc04556c","","x-ray","1.54178","CuKα","","0.0451","0.035","","","0.0822","0.087","","","","","","0.992","","","","has coordinates,has disorder","270392","2021-11-06","18:56:39",""
"7129004","26.094","0.002","6.5624","0.0005","9.4316","0.0007","90","","90","","90","","1615.1","0.2","100","","100","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C16 H13 F6 N5 O -","- C16 H13 F6 N5 O -","- C64 H52 F24 N20 O4 -","4","1","","You, Tingjie; Zeng, Si-Hao; Fan, Jianqiang; Wu, Liangliang; Kang, Fangyuan; Liu, Yungen; Che, Chi-Ming","A soluble iron(II)-phthalocyanine-catalyzed intramolecular C(sp<sup>3</sup>)-H amination with alkyl azides.","Chemical communications (Cambridge, England)","2021","57","82","10711","10714","10.1039/d1cc04573c","","","0.71073","MoKα","","0.0475","0.0436","","","0.109","0.1117","","","","","","1.04","","","","has coordinates,has disorder","270400","2021-11-06","19:00:16",""
"7129005","4.6849","0.0008","5.6677","0.001","15.258","0.003","98.838","0.006","91.269","0.006","93.319","0.006","399.46","0.13","100","","100.01","","","","","","","","","5","P 1","P 1","1","","","","- C16 H13 F6 N5 O -","- C16 H13 F6 N5 O -","- C16 H13 F6 N5 O -","1","1","","You, Tingjie; Zeng, Si-Hao; Fan, Jianqiang; Wu, Liangliang; Kang, Fangyuan; Liu, Yungen; Che, Chi-Ming","A soluble iron(II)-phthalocyanine-catalyzed intramolecular C(sp<sup>3</sup>)-H amination with alkyl azides.","Chemical communications (Cambridge, England)","2021","57","82","10711","10714","10.1039/d1cc04573c","","x-ray","0.71073","MoKα","","0.049","0.0377","","","0.0906","0.0949","","","","","","1.03","","","","has coordinates","270400","2021-11-06","19:00:17",""
"7129006","14.2684","0.0004","16.5014","0.0005","21.5435","0.0006","90","","92.706","0.002","90","","5066.7","0.3","294","","294","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C57 H41 F8 Ni O2 P2 -","- C57 H41 F8 Ni O2 P2 -","- C228 H164 F32 Ni4 O8 P8 -","4","1","","Ponce-de-León, Jaime; Espinet, Pablo","Selective synthesis of fluorinated biaryls by [MCl<sub>2</sub>(PhPEWO-F)] (M = Ni, Pd) catalysed Negishi cross-coupling.","Chemical communications (Cambridge, England)","2021","57","83","10875","10878","10.1039/d1cc04915a","","","0.71073","MoKα","","0.088","0.054","","","0.1451","0.1751","","","","","","1.072","","","","has coordinates","270356","2021-11-06","18:46:46",""
"7129011","8.5388","0.0015","17.266","0.003","18.085","0.002","63.591","0.008","80.604","0.013","87.018","0.014","2355.4","0.7","113.15","","113.15","","","","","","","","","6","P -1","-P 1","2","1CeNi","CeNiL(OAc)3","","- C46 H47.9 Ce N6 Ni3 O11 -","- C46 H47 Ce N6 Ni3 O11 -","- C92 H94 Ce2 N12 Ni6 O22 -","2","1","","Nagae, Haruki; Sakamoto, Kazutaka; Fujiwara, Sakiko; Schindler, Tobias; Kon, Yoshihiro; Sato, Kazuhiko; Okuda, Jun; Mashima, Kazushi","Aerobic oxygenation of α-methylene ketones under visible-light catalysed by a CeNi<sub>3</sub> complex with a macrocyclic tris(salen)-ligand.","Chemical communications (Cambridge, England)","2021","57","85","11169","11172","10.1039/d1cc04540g","","x-ray","0.71075","MoKα","","0.0907","0.057","","","0.1379","0.146","","","","","","1.013","","","","has coordinates,has disorder","270382","2021-11-06","18:54:14",""
"7129012","12.221","0.0016","15.1088","0.0019","32.186","0.004","90","","95.719","0.003","90","","5913.4","1.3","113.15","","113.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","1CeZn","CeZn3L(OAc)3","","- C49 H54 Ce Cl0.25 N6 O15 Zn3 -","- C49 H55 Ce Cl3 N6 O13 Zn3 -","- C196 H220 Ce4 Cl12 N24 O52 Zn12 -","4","1","","Nagae, Haruki; Sakamoto, Kazutaka; Fujiwara, Sakiko; Schindler, Tobias; Kon, Yoshihiro; Sato, Kazuhiko; Okuda, Jun; Mashima, Kazushi","Aerobic oxygenation of α-methylene ketones under visible-light catalysed by a CeNi<sub>3</sub> complex with a macrocyclic tris(salen)-ligand.","Chemical communications (Cambridge, England)","2021","57","85","11169","11172","10.1039/d1cc04540g","","x-ray","0.71075","MoKα","","0.1187","0.0738","","","0.1517","0.1685","","","","","","1.162","","","","has coordinates,has disorder","270382","2021-11-06","18:54:17",""
"7129013","8.3694","0.0005","17.4057","0.0011","18.0006","0.0013","62.578","0.003","75.394","0.004","77.11","0.004","2234.9","0.3","113.15","","113.15","","","","","","","","","6","P -1","-P 1","2","6CeNi","CeNi3L(OAc)3","","- C36 H33 Ce N6 Ni3 O12 -","- C36 H33 Ce N6 Ni3 O12 -","- C72 H66 Ce2 N12 Ni6 O24 -","2","1","","Nagae, Haruki; Sakamoto, Kazutaka; Fujiwara, Sakiko; Schindler, Tobias; Kon, Yoshihiro; Sato, Kazuhiko; Okuda, Jun; Mashima, Kazushi","Aerobic oxygenation of α-methylene ketones under visible-light catalysed by a CeNi<sub>3</sub> complex with a macrocyclic tris(salen)-ligand.","Chemical communications (Cambridge, England)","2021","57","85","11169","11172","10.1039/d1cc04540g","","x-ray","0.71075","MoKα","","0.0534","0.0434","","","0.1204","0.1248","","","","","","1.046","","","","has coordinates,has disorder","270382","2021-11-06","18:54:17",""
"7129014","11.375","0.0002","8.8028","0.0002","26.0461","0.0005","90","","92.776","0.001","90","","2604.98","0.09","170","","170","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H22 N2 O2 -","- C38 H22 N2 O2 -","- C152 H88 N8 O8 -","4","1","","Yang, Sheng-Yi; Zou, Sheng-Nan; Kong, Fan-Cheng; Liao, Xiang-Ji; Qu, Yang-Kun; Feng, Zi-Qi; Zheng, You-Xuan; Jiang, Zuo-Quan; Liao, Liang-Sheng","A narrowband blue circularly polarized thermally activated delayed fluorescence emitter with a hetero-helicene structure.","Chemical communications (Cambridge, England)","2021","57","84","11041","11044","10.1039/d1cc04405b","","","1.54178","CuKα","","0.0443","0.0383","","","0.0946","0.0997","","","","","","1.013","","","","has coordinates","270388","2021-11-06","18:55:44",""
"7129015","21.0876","0.0003","21.1132","0.0002","29.7036","0.0003","90","","90","","90","","13224.8","0.3","173","0.1","173","0.1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C60 H79 As2 Mn N12 O19.5 -","- C60 H79 As2 Mn N12 O19.5 -","- C480 H632 As16 Mn8 N96 O156 -","8","1","","Shylin, Sergii I.; Pogrebetsky, James L.; Husak, Alina O.; Bykov, Dmytro; Mokhir, Andriy; Hampel, Frank; Shova, Sergiu; Ozarowski, Andrew; Gumienna-Kontecka, Elzbieta; Fritsky, Igor O.","Expanding manganese(IV) aqueous chemistry: unusually stable water-soluble hexahydrazide clathrochelate complexes.","Chemical communications (Cambridge, England)","2021","57","84","11060","11063","10.1039/d1cc04870h","","x-ray","1.54184","CuKα","","0.0496","0.0436","","","0.1146","0.1215","","","","","","1.03","","","","has coordinates","270391","2021-11-06","18:56:29",""
"7129016","9.9513","0.0007","11.2457","0.0008","11.7458","0.0009","106.127","0.007","93.29","0.006","106.007","0.006","1200.93","0.17","160","1","160","1","","","","","","","","6","P -1","-P 1","2","","","","- C12 H26 Mn N12 Na2 O13 -","- C12 H26 Mn N12 Na2 O13 -","- C24 H52 Mn2 N24 Na4 O26 -","2","1","","Shylin, Sergii I.; Pogrebetsky, James L.; Husak, Alina O.; Bykov, Dmytro; Mokhir, Andriy; Hampel, Frank; Shova, Sergiu; Ozarowski, Andrew; Gumienna-Kontecka, Elzbieta; Fritsky, Igor O.","Expanding manganese(IV) aqueous chemistry: unusually stable water-soluble hexahydrazide clathrochelate complexes.","Chemical communications (Cambridge, England)","2021","57","84","11060","11063","10.1039/d1cc04870h","","","0.71073","MoKα","","0.0449","0.036","","","0.0824","0.0868","","","","","","1.041","","","","has coordinates","270391","2021-11-06","18:56:30",""
"7129017","6.8686","0.0009","21.053","0.003","7.1521","0.0009","90","","95.021","0.004","90","","1030.3","0.2","295","2","295.24","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-dimethyl-4-nitrobenzohydrazide","","- C9 H11 N3 O3 -","- C9 H11 N3 O3 -","- C36 H44 N12 O12 -","4","1","","Deka, Jugal Kishore Rai; Kalita, Debajit; Sahariah, Biswajit; Sarma, Bani Kanta","n<sub>N</sub> → π*<sub>Ar</sub> interactions stabilize the <i>E</i>-ac isomers of arylhydrazides and facilitate their S<sub>N</sub>Ar autocyclizations.","Chemical communications (Cambridge, England)","2021","57","85","11236","11239","10.1039/d1cc04533d","","","0.71073","MoKα","","0.1246","0.0503","","","0.1092","0.1519","","","","","","1.05","","","","has coordinates","270386","2021-11-06","18:54:50",""
"7129018","6.0949","0.0002","9.8024","0.0003","18.4664","0.0005","90","","90","","90","","1103.27","0.06","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N,N',N'-trimethyl-4-nitrobenzohydrazide","","- C10 H13 N3 O3 -","- C10 H13 N3 O3 -","- C40 H52 N12 O12 -","4","1","","Deka, Jugal Kishore Rai; Kalita, Debajit; Sahariah, Biswajit; Sarma, Bani Kanta","n<sub>N</sub> → π*<sub>Ar</sub> interactions stabilize the <i>E</i>-ac isomers of arylhydrazides and facilitate their S<sub>N</sub>Ar autocyclizations.","Chemical communications (Cambridge, England)","2021","57","85","11236","11239","10.1039/d1cc04533d","","","0.71073","MoKα","","0.0473","0.0365","","","0.0833","0.0914","","","","","","1.079","","","","has coordinates","270386","2021-11-06","18:54:51",""
"7129019","7.4997","0.0006","18.7572","0.0015","7.4345","0.0007","90","","100.331","0.003","90","","1028.88","0.15","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-cyano-N,N'-dimethylbenzohydrazide","","- C10 H11 N3 O -","- C10 H11 N3 O -","- C40 H44 N12 O4 -","4","1","","Deka, Jugal Kishore Rai; Kalita, Debajit; Sahariah, Biswajit; Sarma, Bani Kanta","n<sub>N</sub> → π*<sub>Ar</sub> interactions stabilize the <i>E</i>-ac isomers of arylhydrazides and facilitate their S<sub>N</sub>Ar autocyclizations.","Chemical communications (Cambridge, England)","2021","57","85","11236","11239","10.1039/d1cc04533d","","","0.71073","MoKα","","0.111","0.0586","","","0.1639","0.22","","","","","","1.128","","","","has coordinates","270386","2021-11-06","18:54:51",""
"7129020","12.3475","0.0008","18.8728","0.0011","3.9943","0.0002","90","","90","","90","","930.8","0.09","302","2","302","2","","","","","","","","4","P n a 21","P 2c -2n","33","","1,2-dimethyl-6-nitro-1H-indazol-3(2H)-one","","- C9 H9 N3 O3 -","- C9 H9 N3 O3 -","- C36 H36 N12 O12 -","4","1","","Deka, Jugal Kishore Rai; Kalita, Debajit; Sahariah, Biswajit; Sarma, Bani Kanta","n<sub>N</sub> → π*<sub>Ar</sub> interactions stabilize the <i>E</i>-ac isomers of arylhydrazides and facilitate their S<sub>N</sub>Ar autocyclizations.","Chemical communications (Cambridge, England)","2021","57","85","11236","11239","10.1039/d1cc04533d","","","0.71073","MoKα","","0.044","0.0348","","","0.086","0.0937","","","","","","1.113","","","","has coordinates","270386","2021-11-06","18:54:51",""
"7129021","6.6018","0.0004","13.8377","0.001","12.6315","0.0008","90","","90.58","0.002","90","","1153.88","0.13","299","2","299","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-cyano-N,N',N'-trimethylbenzohydrazide","","- C11 H13 N3 O -","- C11 H13 N3 O -","- C44 H52 N12 O4 -","4","1","","Deka, Jugal Kishore Rai; Kalita, Debajit; Sahariah, Biswajit; Sarma, Bani Kanta","n<sub>N</sub> → π*<sub>Ar</sub> interactions stabilize the <i>E</i>-ac isomers of arylhydrazides and facilitate their S<sub>N</sub>Ar autocyclizations.","Chemical communications (Cambridge, England)","2021","57","85","11236","11239","10.1039/d1cc04533d","","","0.71073","MoKα","","0.0655","0.0456","","","0.1245","0.141","","","","","","1.09","","","","has coordinates","270386","2021-11-06","18:54:51",""
"7129022","9.779","0.003","12.795","0.004","10.02","0.003","90","","116.776","0.01","90","","1119.3","0.6","299","2","299","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-methoxy-N,N',N'-trimethylbenzohydrazide","","- C11 H16 N2 O2 -","- C11 H16 N2 O2 -","- C44 H64 N8 O8 -","4","1","","Deka, Jugal Kishore Rai; Kalita, Debajit; Sahariah, Biswajit; Sarma, Bani Kanta","n<sub>N</sub> → π*<sub>Ar</sub> interactions stabilize the <i>E</i>-ac isomers of arylhydrazides and facilitate their S<sub>N</sub>Ar autocyclizations.","Chemical communications (Cambridge, England)","2021","57","85","11236","11239","10.1039/d1cc04533d","","","0.71073","MoKα","","0.056","0.0429","","","0.1127","0.1238","","","","","","1.071","","","","has coordinates","270386","2021-11-06","18:54:51",""
"7129023","13.453","0.0002","8.6713","0.0001","30.2422","0.0003","90","","90.066","0.0009","90","","3527.9","0.08","150","2","150","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C46 H38 N6 -","- C46 H38 N6 -","- C184 H152 N24 -","4","1","","López-Alled, Carlos M; Park, Sang Jun; Lee, Dong Joon; Murfin, Lloyd C.; Kociok-Köhn, Gabriele; Hann, Jodie L.; Wenk, Jannis; James, Tony D.; Kim, Hwan Myung; Lewis, Simon E.","Azulene-based fluorescent chemosensor for adenosine diphosphate.","Chemical communications (Cambridge, England)","2021","57","81","10608","10611","10.1039/d1cc04122c","","x-ray","1.54184","CuKα","","0.0551","0.0444","","","0.1087","0.1147","","","","","","1.061","","","","has coordinates,has disorder","270357","2021-11-06","18:47:00",""
"7129024","13.6047","0.0003","9.8218","0.0002","29.367","0.0011","90","","100.398","0.003","90","","3859.65","0.19","150","2","150","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C48 H41 N7 -","- C48 H41 N7 -","- C192 H164 N28 -","4","1","","López-Alled, Carlos M; Park, Sang Jun; Lee, Dong Joon; Murfin, Lloyd C.; Kociok-Köhn, Gabriele; Hann, Jodie L.; Wenk, Jannis; James, Tony D.; Kim, Hwan Myung; Lewis, Simon E.","Azulene-based fluorescent chemosensor for adenosine diphosphate.","Chemical communications (Cambridge, England)","2021","57","81","10608","10611","10.1039/d1cc04122c","","x-ray","1.54184","CuKα","","0.088","0.0688","","","0.1669","0.178","","","","","","1.121","","","","has coordinates,has disorder","270357","2021-11-06","18:47:00",""
"7129025","21.3009","0.0005","21.3009","0.0005","7.7405","0.0003","90","","90","","90","","3512.08","0.18","293","2","293","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","","","- C23 H19 N O -","- C23 H19 N O -","- C184 H152 N8 O8 -","8","1","","Wei, Hao-Zhao; Wei, Yin; Shi, Min","Construction of an isoquinolinone framework from carboxylic-ester-directed umpolung ring opening of methylenecyclopropanes.","Chemical communications (Cambridge, England)","2021","57","85","11201","11204","10.1039/d1cc04826k","","","0.71073","MoKα","","0.0389","0.0326","","","0.0797","0.0845","","","","","","1.052","","","","has coordinates","270385","2021-11-06","18:54:41",""
"7129026","5.5414","0.0005","9.702","0.001","16.4455","0.0017","98.437","0.003","98.614","0.003","97.851","0.003","853.28","0.15","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H18 N2 O -","- C22 H18 N2 O -","- C44 H36 N4 O2 -","2","1","","Wei, Hao-Zhao; Wei, Yin; Shi, Min","Construction of an isoquinolinone framework from carboxylic-ester-directed umpolung ring opening of methylenecyclopropanes.","Chemical communications (Cambridge, England)","2021","57","85","11201","11204","10.1039/d1cc04826k","","","0.71073","MoKα","","0.0522","0.041","","","0.0978","0.1066","","","","","","1.042","","","","has coordinates","270385","2021-11-06","18:54:41",""
"7129027","7.0765","0.0004","7.2293","0.0003","18.9898","0.0009","90","","92.749","0.002","90","","970.36","0.08","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","boron trichloride dimethyl sulfide","","","- C2 H6 B I3 S -","- C2 H6 B I3 S -","- C8 H24 B4 I12 S4 -","4","1","","Frenette, Brandon L.; Omaña, Alvaro A; Ferguson, Michael J.; Zhou, Yuqiao; Rivard, Eric","Access to adducts of parent iminoborane isomers, HBNH and NBH<sub>2</sub>, using frustrated Lewis pair chelation.","Chemical communications (Cambridge, England)","2021","57","83","10895","10898","10.1039/d1cc04923b","","","1.54178","CuKα","","0.0305","0.0297","","","0.078","0.0787","","","","","","1.053","","","","has coordinates","270353","2021-11-06","18:46:15",""
"7129028","11.6992","0.0012","9.8865","0.001","21.0275","0.0019","90","","90.527","0.002","90","","2432","0.4","173.15","","173.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","PB(NBH2)","","","- C24 H42 B2 N P -","- C24 H42 B2 N P -","- C96 H168 B8 N4 P4 -","4","1","","Frenette, Brandon L.; Omaña, Alvaro A; Ferguson, Michael J.; Zhou, Yuqiao; Rivard, Eric","Access to adducts of parent iminoborane isomers, HBNH and NBH<sub>2</sub>, using frustrated Lewis pair chelation.","Chemical communications (Cambridge, England)","2021","57","83","10895","10898","10.1039/d1cc04923b","","","0.71073","MoKα","","0.0887","0.063","","","0.1632","0.1809","","","","","","1.027","","","","has coordinates","270353","2021-11-06","18:46:15",""
"7129029","9.4802","0.0007","10.2175","0.0008","15.3118","0.0011","90","","99.894","0.001","90","","1461.1","0.19","173.15","","173.15","","","","","","","","","6","P 1 n 1","P -2yac","7","PB(N3SiMe3)","","","- C27 H49 B N3 P Si -","- C27 H49 B N3 P Si -","- C54 H98 B2 N6 P2 Si2 -","2","1","","Frenette, Brandon L.; Omaña, Alvaro A; Ferguson, Michael J.; Zhou, Yuqiao; Rivard, Eric","Access to adducts of parent iminoborane isomers, HBNH and NBH<sub>2</sub>, using frustrated Lewis pair chelation.","Chemical communications (Cambridge, England)","2021","57","83","10895","10898","10.1039/d1cc04923b","","","0.71073","MoKα","","0.0328","0.0301","","","0.0737","0.0755","","","","","","1.031","","","","has coordinates","270353","2021-11-06","18:46:15",""
"7129030","10.7171","0.0003","16.7686","0.0005","17.2773","0.0006","68.428","0.002","75.826","0.002","77.713","0.002","2773.46","0.15","193","2","193","2","","","","","","","","6","P -1","-P 1","2","[PB(NLi)2]","","","- C57 H101 B2 Li2 N2 P2 -","- C48 H80 B2 Li2 N2 P2 -","- C96 H160 B4 Li4 N4 P4 -","2","1","","Frenette, Brandon L.; Omaña, Alvaro A; Ferguson, Michael J.; Zhou, Yuqiao; Rivard, Eric","Access to adducts of parent iminoborane isomers, HBNH and NBH<sub>2</sub>, using frustrated Lewis pair chelation.","Chemical communications (Cambridge, England)","2021","57","83","10895","10898","10.1039/d1cc04923b","","","1.54178","CuKα","","0.0987","0.0765","","","0.2004","0.2176","","","","","","1.071","","","","has coordinates,has disorder","270353","2021-11-06","18:46:15",""
"7129031","10.5379","0.0003","9.652","0.0003","22.5624","0.0006","90","","92.7034","0.0012","90","","2292.31","0.11","193.15","","193.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","PB(NH)","","","- C24 H41 B N P -","- C24 H41 B N P -","- C96 H164 B4 N4 P4 -","4","1","","Frenette, Brandon L.; Omaña, Alvaro A; Ferguson, Michael J.; Zhou, Yuqiao; Rivard, Eric","Access to adducts of parent iminoborane isomers, HBNH and NBH<sub>2</sub>, using frustrated Lewis pair chelation.","Chemical communications (Cambridge, England)","2021","57","83","10895","10898","10.1039/d1cc04923b","","","1.54178","CuKα","","0.0375","0.0345","","","0.093","0.0956","","","","","","1.059","","","","has coordinates","270353","2021-11-06","18:46:15",""
"7129032","9.5926","0.0012","11.0351","0.0014","16.641","0.002","98.954","0.002","98.334","0.002","99.92","0.002","1687.1","0.4","173.15","","173.15","","","","","","","","","6","P -1","-P 1","2","PB(NBH2)-DMAP","","","- C32 H54 B2 Cl2 N3 P -","- C32 H54 B2 Cl2 N3 P -","- C64 H108 B4 Cl4 N6 P2 -","2","1","","Frenette, Brandon L.; Omaña, Alvaro A; Ferguson, Michael J.; Zhou, Yuqiao; Rivard, Eric","Access to adducts of parent iminoborane isomers, HBNH and NBH<sub>2</sub>, using frustrated Lewis pair chelation.","Chemical communications (Cambridge, England)","2021","57","83","10895","10898","10.1039/d1cc04923b","","","0.71073","MoKα","","0.0676","0.043","","","0.0991","0.1116","","","","","","1.023","","","","has coordinates,has disorder","270353","2021-11-06","18:46:15",""
"7129033","19.7455","0.0006","10.968","0.0003","23.1511","0.0007","90","","102.217","0.002","90","","4900.3","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","PB(H2BNH2)","","","- C24 H44 B2 N P -","- C24 H44 B2 N P -","- C192 H352 B16 N8 P8 -","8","2","","Frenette, Brandon L.; Omaña, Alvaro A; Ferguson, Michael J.; Zhou, Yuqiao; Rivard, Eric","Access to adducts of parent iminoborane isomers, HBNH and NBH<sub>2</sub>, using frustrated Lewis pair chelation.","Chemical communications (Cambridge, England)","2021","57","83","10895","10898","10.1039/d1cc04923b","","","1.54178","CuKα","","0.0593","0.0432","","","0.1068","0.1175","","","","","","1.027","","","","has coordinates","270353","2021-11-06","18:46:15",""
"7129034","11.1624","0.0004","9.3546","0.0003","23.6269","0.0008","90","","99.5776","0.0019","90","","2432.73","0.14","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","PB(HBNH)","","","- C24 H42 B2 N P -","- C24 H42 B2 N P -","- C96 H168 B8 N4 P4 -","4","1","","Frenette, Brandon L.; Omaña, Alvaro A; Ferguson, Michael J.; Zhou, Yuqiao; Rivard, Eric","Access to adducts of parent iminoborane isomers, HBNH and NBH<sub>2</sub>, using frustrated Lewis pair chelation.","Chemical communications (Cambridge, England)","2021","57","83","10895","10898","10.1039/d1cc04923b","","","1.54178","CuKα","","0.0554","0.0519","","","0.134","0.1376","","","","","","1.094","","","","has coordinates","270353","2021-11-06","18:46:15",""
"7129035","18.2679","0.0005","11.4128","0.0004","14.6131","0.0004","90","","107.048","0.002","90","","2912.78","0.16","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","PB(HIBNH2)","","","- C27 H50 B2 I N P -","- C24 H43 B2 I N P -","- C96 H172 B8 I4 N4 P4 -","4","1","","Frenette, Brandon L.; Omaña, Alvaro A; Ferguson, Michael J.; Zhou, Yuqiao; Rivard, Eric","Access to adducts of parent iminoborane isomers, HBNH and NBH<sub>2</sub>, using frustrated Lewis pair chelation.","Chemical communications (Cambridge, England)","2021","57","83","10895","10898","10.1039/d1cc04923b","","","1.54178","CuKα","","0.0816","0.0539","","","0.1232","0.138","","","","","","1.056","","","","has coordinates","270353","2021-11-06","18:46:15",""
"7129036","7.325","0.0004","12.3657","0.0005","27.819","0.0012","90","","90","","90","","2519.8","0.2","170","2","170","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H12 Br N5 -","- C13 H12 Br N5 -","- C104 H96 Br8 N40 -","8","1","","Zhao, Wanqiu; Zhang, Cheng; Zhong, Pengzhen; Zhou, Wei; Zhang, Chen; Cui, Dong-Mei","Diversity-oriented synthesis of imidazo[1,2-<i>a</i>][1,3,5]triazine derivatives from 2-amine-[1,3,5]triazines with ketones.","Chemical communications (Cambridge, England)","2021","57","82","10715","10718","10.1039/d1cc04294g","","","0.71073","MoKα","","0.0406","0.0375","","","0.0835","0.0856","","","","","","1.076","","","","has coordinates","270403","2021-11-06","19:02:09",""
"7129037","11.231","0.002","7.9355","0.0016","39.428","0.008","90","","90","","90","","3514","1.2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C21 H17 N5 O2 -","- C21 H17 N5 O2 -","- C168 H136 N40 O16 -","8","1","","Zhao, Wanqiu; Zhang, Cheng; Zhong, Pengzhen; Zhou, Wei; Zhang, Chen; Cui, Dong-Mei","Diversity-oriented synthesis of imidazo[1,2-<i>a</i>][1,3,5]triazine derivatives from 2-amine-[1,3,5]triazines with ketones.","Chemical communications (Cambridge, England)","2021","57","82","10715","10718","10.1039/d1cc04294g","","","0.71073","MoKα","","0.0514","0.0406","","","0.1039","0.1178","","","","","","1.139","","","","has coordinates","270403","2021-11-06","19:02:10",""
"7129038","13.982","0.002","23.272","0.004","20.029","0.003","90","","94.935","0.003","90","","6493.1","1.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C61 H83 Br4 N4 O13 -","- C61 H83 Br4 N4 O13 -","- C244 H332 Br16 N16 O52 -","4","1","","Hodson, Luke; Visagie, Kevin J.; Smith, Michael-Phillip; Loots, Leigh; Kuter, David; Snayer, Trégen M; Arnott, Gareth E.","Facile synthesis of a <i>C</i><sub>4</sub>-symmetrical inherently chiral calix[4]arene.","Chemical communications (Cambridge, England)","2021","57","84","11045","11048","10.1039/d1cc04607a","","","0.71073","MoKα","","0.0811","0.0462","","","0.0958","0.1102","","","","","","1.014","","","","has coordinates,has disorder","270389","2021-11-06","18:55:58",""
"7129039","14.4769","0.0008","10.6369","0.0006","20.1652","0.0011","90","","96.305","0.002","90","","3086.4","0.3","100","","100","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C36 H80 Fe2 K2 N2 O12 S2 Si4 -","- C36 H80 Fe2 K2 N2 O12 S2 Si4 -","- C72 H160 Fe4 K4 N4 O24 S4 Si8 -","2","0.5","","Schneider, Christian; Groß, Sophie J; Demeshko, Serhiy; Bontemps, Sébastien; Meyer, Franc; Werncke, C. Gunnar","Synthesis and characterisation of a very low-coordinate diferrous [2Fe-2S]<sup>0</sup> unit.","Chemical communications (Cambridge, England)","2021","57","82","10751","10754","10.1039/d1cc04196g","","x-ray","0.71073","MoKα","","0.0421","0.0327","","","0.0828","0.087","","","","","","1.04","","","","has coordinates","270402","2021-11-06","19:02:00",""
"7129040","13.1814","0.0007","17.5638","0.0008","19.7643","0.0009","65.201","0.001","87.028","0.001","83.569","0.001","4127.6","0.3","100","","100","","","","","","","","","8","P -1","-P 1","2","","","","- C25 H58 Fe K N2 O6 S3 Si4 -","- C25 H60 Fe K N2 O6 S3 Si4 -","- C100 H240 Fe4 K4 N8 O24 S12 Si16 -","4","2","","Schneider, Christian; Groß, Sophie J; Demeshko, Serhiy; Bontemps, Sébastien; Meyer, Franc; Werncke, C. Gunnar","Synthesis and characterisation of a very low-coordinate diferrous [2Fe-2S]<sup>0</sup> unit.","Chemical communications (Cambridge, England)","2021","57","82","10751","10754","10.1039/d1cc04196g","","x-ray","0.71073","MoKα","","0.0966","0.0534","","","0.1149","0.1264","","","","","","0.984","","","","has coordinates,has disorder","270402","2021-11-06","19:02:00",""
"7129041","12.2287","0.0005","13.8939","0.0006","24.4874","0.001","96.877","0.002","100.914","0.001","102.872","0.002","3925.2","0.3","100","","100","","","","","","","","","8","P -1","-P 1","2","","","","- C50 H125 Fe2 K2 N4 O12.5 S2 Si8 -","- C50 H125 Fe2 K2 N4 O12.5 S2 Si8 -","- C100 H250 Fe4 K4 N8 O25 S4 Si16 -","2","1","","Schneider, Christian; Groß, Sophie J; Demeshko, Serhiy; Bontemps, Sébastien; Meyer, Franc; Werncke, C. Gunnar","Synthesis and characterisation of a very low-coordinate diferrous [2Fe-2S]<sup>0</sup> unit.","Chemical communications (Cambridge, England)","2021","57","82","10751","10754","10.1039/d1cc04196g","","x-ray","0.71073","MoKα","","0.0615","0.0391","","","0.0714","0.0768","","","","","","1.036","","","","has coordinates,has disorder","270402","2021-11-06","19:02:00",""
"7129042","12.4251","0.0008","18.3927","0.0012","25.1535","0.0018","103.471","0.003","90.449","0.004","103.813","0.004","5416.3","0.6","100","2","99.92","","","","","","","","","5","P -1","-P 1","2","","","","- C96 H153 Bi8 O3 Sn3 -","- C96 H153 Bi8 O3 Sn3 -","- C192 H306 Bi16 O6 Sn6 -","2","1","","Steller, Beate G.; Flock, Michaela; Fischer, Roland C.","From organotin hydrides to heteronuclear main group metal compounds: isolation of the first neutral bismuth/tin clusters.","Chemical communications (Cambridge, England)","2021","57","78","10095","10098","10.1039/d1cc02538d","","x-ray","0.71073","MoKα","","0.07","0.043","","","0.0919","0.1032","","","","","","0.908","","","","has coordinates","269402","2021-09-30","21:58:29",""
"7129043","11.8602","0.0007","25.223","0.002","22.4048","0.0017","90","","94.905","0.003","90","","6677.8","0.8","249.95","","249.95","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C72 H102 Sn3 -","- C72 H102 Sn3 -","- C288 H408 Sn12 -","4","0.5","","Steller, Beate G.; Flock, Michaela; Fischer, Roland C.","From organotin hydrides to heteronuclear main group metal compounds: isolation of the first neutral bismuth/tin clusters.","Chemical communications (Cambridge, England)","2021","57","78","10095","10098","10.1039/d1cc02538d","","x-ray","0.71073","MoKα","","0.0514","0.0322","","","0.0608","0.0713","","","","","","1.08","","","","has coordinates,has disorder","269402","2021-09-30","21:58:38",""
"7129044","25.7205","0.0009","16.528","0.0006","23.012","0.0009","90","","111.63","0.002","90","","9093.7","0.6","100.14","","100.14","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C80 H122 Bi8 O4 Sn3 -","- C80 H122 Bi8 O4 Sn3 -","- C320 H488 Bi32 O16 Sn12 -","4","0.5","","Steller, Beate G.; Flock, Michaela; Fischer, Roland C.","From organotin hydrides to heteronuclear main group metal compounds: isolation of the first neutral bismuth/tin clusters.","Chemical communications (Cambridge, England)","2021","57","78","10095","10098","10.1039/d1cc02538d","","x-ray","0.71073","MoKα","","0.0432","0.0323","","","0.0707","0.0757","","","","","","1.071","","","","has coordinates","269402","2021-09-30","21:58:38",""
"7129045","15.2666","0.0009","16.4529","0.0008","21.894","0.0012","78.431","0.002","80.056","0.002","75.059","0.002","5162.8","0.5","100","2","100.11","","","","","","","","","5","P -1","-P 1","2","","","","- C100 H148 Bi4 O2 Sn4 -","- C100 H148 Bi4 O2 Sn4 -","- C200 H296 Bi8 O4 Sn8 -","2","1","","Steller, Beate G.; Flock, Michaela; Fischer, Roland C.","From organotin hydrides to heteronuclear main group metal compounds: isolation of the first neutral bismuth/tin clusters.","Chemical communications (Cambridge, England)","2021","57","78","10095","10098","10.1039/d1cc02538d","","x-ray","0.71073","MoKα","","0.0718","0.0455","","","0.0859","0.0965","","","","","","1.048","","","","has coordinates","269402","2021-09-30","21:58:38",""
"7129046","14.1893","0.0005","14.1893","0.0005","37.5042","0.0015","90","","90","","90","","7551","0.5","100","2","100","","","","","","","","","5","P 41","P 4w","76","","","","- C76 H110 Bi2 O2 Sn4 -","- C76 H110 Bi2 O2 Sn4 -","- C304 H440 Bi8 O8 Sn16 -","4","1","","Steller, Beate G.; Flock, Michaela; Fischer, Roland C.","From organotin hydrides to heteronuclear main group metal compounds: isolation of the first neutral bismuth/tin clusters.","Chemical communications (Cambridge, England)","2021","57","78","10095","10098","10.1039/d1cc02538d","","x-ray","0.71073","MoKα","","0.0565","0.0509","","","0.1147","0.1172","","","","","","1.064","","","","has coordinates","269402","2021-09-30","21:58:38",""
"7129047","14.1148","0.0005","14.1612","0.0005","31.9318","0.0011","78.826","0.002","89.605","0.002","81.323","0.002","6188.3","0.4","100","2","100.01","","","","","","","","","4","P -1","-P 1","2","","","","- C60 H93 Bi2 Sn2 -","- C60 H93 Bi2 Sn2 -","- C240 H372 Bi8 Sn8 -","4","2","","Steller, Beate G.; Flock, Michaela; Fischer, Roland C.","From organotin hydrides to heteronuclear main group metal compounds: isolation of the first neutral bismuth/tin clusters.","Chemical communications (Cambridge, England)","2021","57","78","10095","10098","10.1039/d1cc02538d","","x-ray","0.71073","MoKα","","0.1222","0.0716","","","0.1337","0.1534","","","","","","1.135","","","","has coordinates,has disorder","269402","2021-09-30","21:58:38",""
"7129048","11.336","0.0004","11.9463","0.0003","16.0968","0.0007","90","","90","","90","","2179.88","0.13","293","2","293.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H25 N3 O4 -","- C25 H25 N3 O4 -","- C100 H100 N12 O16 -","4","1","","Li, Haizhen; Wu, Jinyu; Zheng, Jianfeng; Li, Wei-Dong Z","Synthesis of polycyclic spiroindolines <i>via</i> the cascade reaction of 3-(2-isocyanoethyl)indoles.","Chemical communications (Cambridge, England)","2021","57","84","11092","11095","10.1039/d1cc04576h","","x-ray","0.71073","MoKα","","0.0834","0.0567","","","0.1245","0.1399","","","","","","1.028","","","","has coordinates","270390","2021-11-06","18:56:09",""
"7129049","15.8169","0.0018","16.0922","0.0013","23.146","0.002","90","","105.329","0.013","90","","5681.7","1","293","2","293.15","","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C29 H31 N3 O6 -","- C29 H31 N3 O6 -","- C232 H248 N24 O48 -","8","1","","Li, Haizhen; Wu, Jinyu; Zheng, Jianfeng; Li, Wei-Dong Z","Synthesis of polycyclic spiroindolines <i>via</i> the cascade reaction of 3-(2-isocyanoethyl)indoles.","Chemical communications (Cambridge, England)","2021","57","84","11092","11095","10.1039/d1cc04576h","","x-ray","0.71073","MoKα","","0.1098","0.0639","","","0.167","0.1906","","","","","","1.049","","","","has coordinates,has disorder","270390","2021-11-06","18:56:09",""
"7129050","7.4924","0.0004","9.4682","0.0005","9.6821","0.0005","112.93","0.002","109.052","0.002","90.147","0.002","591.24","0.06","297","2","297.15","","","","","","","","","4","P -1","-P 1","2","","Form 1","","- C32 H14 N4 S2 -","- C32 H14 N4 S2 -","- C32 H14 N4 S2 -","1","0.5","","Yang, Canglei; Luo, Lixing; Chen, Jinqiu; Yang, Bo; Wang, Wei; Wang, Hebin; Long, Guankui; Liu, Guangfeng; Zhang, Jing; Huang, Wei","Helical mesoscopic crystals based on an achiral charge-transfer complex with controllable untwisting/breaking.","Chemical communications (Cambridge, England)","2021","57","78","10031","10034","10.1039/d1cc03767f","","","1.54178","CuKα","","0.0679","0.0606","","","0.1963","0.2071","","","","","","1.117","","","","has coordinates,has disorder","269404","2021-09-30","22:00:17",""
"7129051","7.551","0.005","9.095","0.006","9.799","0.007","67.642","0.013","86.816","0.015","74.351","0.014","598.5","0.7","292","2","292.11","","","","","","","","","4","P -1","-P 1","2","","","","- C32 H12 N4 S2 -","- C32 H14 N4 S2 -","- C32 H14 N4 S2 -","1","0.5","","Yang, Canglei; Luo, Lixing; Chen, Jinqiu; Yang, Bo; Wang, Wei; Wang, Hebin; Long, Guankui; Liu, Guangfeng; Zhang, Jing; Huang, Wei","Helical mesoscopic crystals based on an achiral charge-transfer complex with controllable untwisting/breaking.","Chemical communications (Cambridge, England)","2021","57","78","10031","10034","10.1039/d1cc03767f","","","0.71073","MoKα","","0.1339","0.0823","","","0.2149","0.2339","","","","","","0.999","","","","has coordinates,has disorder","269404","2021-09-30","22:00:18",""
"7129052","9.66","0.004","14.86","0.008","10.952","0.005","90","","102.555","0.017","90","","1534.5","1.3","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 N O -","- C19 H19 N O -","- C76 H76 N4 O4 -","4","1","","Seo, Sanghyup; Kim, Donghyeon; Kim, Hyunwoo","Ligand-controlled, Pd/CuH-catalyzed reductive cross-coupling of terminal alkenes and <i>N</i>-heteroaryl bromides.","Chemical communications (Cambridge, England)","2021","57","85","11240","11243","10.1039/d1cc04833c","","","0.71073","MoKα","","0.1434","0.0682","","","0.17","0.2149","","","","","","0.988","","","","has coordinates","270379","2021-11-06","18:52:58",""
"7129053","11.8344","0.0006","7.8851","0.0003","14.4218","0.0012","90","","113.414","0.005","90","","1234.96","0.14","297.98","0.1","297.98","0.1","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C7 H17 Cl2 Cr N O3 -","- C7 H17 Cl2 Cr N O3 -","- C28 H68 Cl8 Cr4 N4 O12 -","4","1","","Han, Ding-Chong; Gong, Zhi-Xiang; Song, Ning; Tan, Yu-Hui; Li, Yu-Kong; Tang, Yun-Zhi; Du, Peng-Kang; Zhang, Hao","Ferroelectric properties, narrow band gap and ultra-large reversible entropy change in a novel nonlinear ionic chromium(VI) compound.","Chemical communications (Cambridge, England)","2021","57","85","11225","11228","10.1039/d1cc04751e","","x-ray","0.71073","MoKα","","0.0369","0.0346","","","0.1007","0.1026","","","","","","1.097","","","","has coordinates,has disorder","270377","2021-11-06","18:52:43",""
"7129054","12.8432","0.0006","14.0502","0.0006","16.6156","0.0007","90","","93.34","0.002","90","","2993.2","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H33 N4 O2 Rh -","- C36 H33 N4 O2 Rh -","- C144 H132 N16 O8 Rh4 -","4","1","","Kang, Ju Young; An, Won; Kim, Suho; Kwon, Na Yeon; Jeong, Taejoo; Ghosh, Prithwish; Kim, Hyung Sik; Mishra, Neeraj Kumar; Kim, In Su","Synthesis of spirosuccinimides <i>via</i> annulative cyclization between <i>N</i>-aryl indazolols and maleimides under rhodium(III) catalysis.","Chemical communications (Cambridge, England)","2021","57","83","10947","10950","10.1039/d1cc04599g","","","0.71073","MoKα","","0.0369","0.0313","","","0.0814","0.0868","","","","","","1.06","","","","has coordinates","270355","2021-11-06","18:46:38",""
"7129055","6.772","0.002","9.153","0.002","9.331","0.002","70.25","0.007","87.119","0.008","72.184","0.008","517.3","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H10 N2 O -","- C13 H10 N2 O -","- C26 H20 N4 O2 -","2","1","","Kang, Ju Young; An, Won; Kim, Suho; Kwon, Na Yeon; Jeong, Taejoo; Ghosh, Prithwish; Kim, Hyung Sik; Mishra, Neeraj Kumar; Kim, In Su","Synthesis of spirosuccinimides <i>via</i> annulative cyclization between <i>N</i>-aryl indazolols and maleimides under rhodium(III) catalysis.","Chemical communications (Cambridge, England)","2021","57","83","10947","10950","10.1039/d1cc04599g","","","0.71073","MoKα","","0.064","0.0491","","","0.1134","0.1209","","","","","","1.06","","","","has coordinates","270355","2021-11-06","18:46:38",""
"7129056","6.9026","0.00014","6.93126","0.00015","23.3243","0.0004","90","","90","","90","","1115.92","0.04","293","0.7","293","0.7","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H11 Cl O2 -","- C13 H11 Cl O2 -","- C52 H44 Cl4 O8 -","4","1","","Zhang, Xiao-Yan; Shao, Ya-Ping; Guo, Bao-Kuan; Zhang, Kun; Zhang, Fu-Min; Zhang, Xiao-Ming; Tu, Yong-Qiang","Catalytic enantioselective synthesis of chiral spirocyclic 1,3-diketones <i>via</i> organo-cation catalysis.","Chemical communications (Cambridge, England)","2021","57","85","11233","11235","10.1039/d1cc05205e","","x-ray","1.54184","CuKα","","0.0363","0.0335","","","0.0862","0.0884","","","","","","1.075","","","","has coordinates","270384","2021-11-06","18:54:33",""
"7129057","13.6872","0.0008","6.062","0.0003","14.0247","0.0009","90","","105.577","0.007","90","","1120.91","0.12","292.69","0.1","292.69","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H11 Cl O2 -","- C13 H11 Cl O2 -","- C52 H44 Cl4 O8 -","4","1","","Zhang, Xiao-Yan; Shao, Ya-Ping; Guo, Bao-Kuan; Zhang, Kun; Zhang, Fu-Min; Zhang, Xiao-Ming; Tu, Yong-Qiang","Catalytic enantioselective synthesis of chiral spirocyclic 1,3-diketones <i>via</i> organo-cation catalysis.","Chemical communications (Cambridge, England)","2021","57","85","11233","11235","10.1039/d1cc05205e","","x-ray","1.54184","CuKα","","0.0624","0.046","","","0.1158","0.1323","","","","","","1.026","","","","has coordinates","270384","2021-11-06","18:54:33",""
"7129058","14.9047","0.0003","37.0591","0.001","12.6785","0.0003","90","","90","","90","","7003","0.3","90","0.5","90","0.5","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- C72 H48 -","- C72 H48 -","- C288 H192 -","4","0.5","","Zhou, Xin; Kwon, Hyejin; Thompson, Richard R.; Herman, Robert J.; Fronczek, Frank R.; Bruns, Carson J.; Lee, Semin","Scalable synthesis of [8]cycloparaphenyleneacetylene carbon nanohoop using alkyne metathesis.","Chemical communications (Cambridge, England)","2021","57","83","10887","10890","10.1039/d1cc04776k","","","1.54184","CuKα","","0.072","0.0561","","","0.1496","0.1597","","","","","","1.045","","","","has coordinates,has disorder","270405","2021-11-06","19:02:55",""
"7129059","7.8735","0.0003","13.6168","0.0005","24.1689","0.001","90","","90","","90","","2591.19","0.17","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H22 Br2 O3 -","- C32 H22 Br2 O3 -","- C128 H88 Br8 O12 -","4","1","","Jia, Shiqi; Chang, Yu; Tian, Yuhong; Mao, Hui; Qin, Wenling; Wang, Pengfei; Yan, Hailong","Organocatalytic cascade reactions for multi-functionalized chiral cyclic ethers through vinylidene <i>ortho</i>-quinone methides.","Chemical communications (Cambridge, England)","2021","57","86","11334","11337","10.1039/d1cc05340j","","x-ray","0.71073","MoKα","","0.0737","0.0421","","","0.067","0.0779","","","","","","1.049","","","","has coordinates","270350","2021-11-06","18:44:59",""
"7129060","14.5583","0.0017","15.2367","0.0014","23.782","0.003","96.5875","0.0013","106.1","0.004","106.649","0.004","4746.7","0.9","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C94 H87 B2 F8 N9 P8 Pd4 -","- C94 H87 B2 F8 N9 P8 Pd4 -","- C188 H174 B4 F16 N18 P16 Pd8 -","2","1","","Tanase, Tomoaki; Nakamae, Kanako; Miyano, Haruka; Fujisawa, Yoshimi; Ura, Yasuyuki; Nakajima, Takayuki","Electrochemical hydrogen formation catalysed by a Pd<sub>8</sub> string.","Chemical communications (Cambridge, England)","2021","57","85","11264","11267","10.1039/d1cc04788d","","","0.71075","MoKα","","","0.0368","","","","0.0974","","","","","","1.068","","","","has coordinates","270378","2021-11-06","18:52:50",""
"7129061","16.1768","0.0016","7.6356","0.0007","18.1963","0.0017","90","","92.555","0.004","90","","2245.4","0.4","173","","173","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H23 F3 N2 O6 S -","- C21 H23 F3 N2 O6 S -","- C84 H92 F12 N8 O24 S4 -","4","2","","Oka, Yukari; Tsuzuki, Seiji; Moriyama, Katsuhiko","Chiral anthranilic pyrrolidine as custom-made amine catalyst for enantioselective Michael reaction of nitroalkenes with carbonyl compounds.","Chemical communications (Cambridge, England)","2021","57","87","11457","11460","10.1039/d1cc04453b","","","1.54178","CuKα","","0.056","0.0547","","","0.1526","0.1544","","","","","","1.05","","","","has coordinates,has disorder","270398","2021-11-06","18:59:29",""
"7129062","17.626","0.003","16.38","0.003","24.678","0.006","90","","95.021","0.005","90","","7098","2","296","2","296","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C70 H54 B2 F14 N6 -","- C70 H54 B2 F14 N6 -","- C280 H216 B8 F56 N24 -","4","0.5","","Kalaiselvan, Arumugam; Dhamija, Shaina; Aswathi, Chakrapani; De, Arijit K.; Gokulnath, Sabapathi","Planar hexaphyrin-like macrocycles turning into bis-BODIPYs with box-shaped structures exhibiting excitonic coupling.","Chemical communications (Cambridge, England)","2021","57","87","11485","11488","10.1039/d1cc04403f","","","0.71073","MoKα","","0.1175","0.063","","","0.1631","0.2088","","","","","","1.035","","","","has coordinates,has disorder","270393","2021-11-06","18:57:24",""
"7129063","12.713","0.007","16.637","0.008","17.026","0.013","94.06","0.04","105.49","0.05","104.83","0.03","3317","4","293","2","293.15","","","","","","","","","4","P -1","-P 1","2","","","","- C70 H56 F10 N6 -","- C70 H56 F10 N6 -","- C140 H112 F20 N12 -","2","1","","Kalaiselvan, Arumugam; Dhamija, Shaina; Aswathi, Chakrapani; De, Arijit K.; Gokulnath, Sabapathi","Planar hexaphyrin-like macrocycles turning into bis-BODIPYs with box-shaped structures exhibiting excitonic coupling.","Chemical communications (Cambridge, England)","2021","57","87","11485","11488","10.1039/d1cc04403f","","","0.71073","MoKα","","0.195","0.0727","","","0.1938","0.2808","","","","","","0.974","","","","has coordinates,has disorder","270393","2021-11-06","18:57:24",""
"7129065","12.093","0.0006","13.4589","0.0008","17.0755","0.0007","88.492","0.004","81.618","0.004","77.71","0.004","2686.5","0.2","100.01","0.12","100.01","0.12","","","","","","","","3","P -1","-P 1","2","","","","- C61 H53 O10 -","- C61 H53 O10 -","- C122 H106 O20 -","2","1","","Zhao, Jianyi; Yang, Weiwei; Liang, Chuanyun; Gao, Liya; Xu, Jun; Sue, Andrew C.-H.; Zhao, Hongxia","Rim-differentiated Co-pillar[4+1]arenes.","Chemical communications (Cambridge, England)","2021","57","85","11193","11196","10.1039/d1cc04840f","","x-ray","0.71073","MoKα","","0.1692","0.0859","","","0.2225","0.2662","","","","","","0.968","","","","has coordinates","270381","2021-11-06","18:53:40",""
"7129066","12.9624","0.0002","20.2304","0.0002","23.4932","0.0005","88.725","0.001","77.306","0.002","79.742","0.001","5913.16","0.17","159.99","0.1","159.99","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C121 H115 Br2 Cl3 O20 -","- C121 H115 Br2 Cl3 O20 -","- C242 H230 Br4 Cl6 O40 -","2","1","","Zhao, Jianyi; Yang, Weiwei; Liang, Chuanyun; Gao, Liya; Xu, Jun; Sue, Andrew C.-H.; Zhao, Hongxia","Rim-differentiated Co-pillar[4+1]arenes.","Chemical communications (Cambridge, England)","2021","57","85","11193","11196","10.1039/d1cc04840f","","x-ray","1.54184","CuKα","","0.1049","0.0955","","","0.2614","0.2698","","","","","","1.054","","","","has coordinates","270381","2021-11-06","18:53:40",""
"7129067","26.62","0.01","22.211","0.008","26.964","0.009","90","","117.198","0.006","90","","14180","9","263.15","","263.15","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","monoclinic","","- C80 H70 B2 Cu5 N16 O86 W24 -","- C80 H70 B2 Cu5 N16 O86 W24 -","- C320 H280 B8 Cu20 N64 O344 W96 -","4","1","","Guo, Ke-Ke; Jiang, Xin-Ye; Xu, Ming; Li, Feng-Yan; Dong, Si-Meng; Zheng, Yue; Xu, Lin","An unprecedented polyoxometalate-based 1D double chain compound with opposite charges enables conductivity improvement.","Chemical communications (Cambridge, England)","2021","57","86","11398","11401","10.1039/d1cc03581a","","","0.71073","MoKα","","0.1008","0.0623","","","0.1149","0.1319","","","","","","1.042","","","","has coordinates","270352","2021-11-06","18:45:19",""
"7129068","10.0737","0.0012","19.301","0.002","23.277","0.003","90","","90","","90","","4525.8","0.9","100","","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C44 H62 N6 O2 Zn2 -","- C44 H62 N6 O2 Zn2 -","- C176 H248 N24 O8 Zn8 -","4","1","","Matsumoto, Arimasa; Tanaka, Ayame; Kaimori, Yoshiyasu; Hara, Natsuki; Mikata, Yuji; Soai, Kenso","Circular dichroism spectroscopy of catalyst preequilibrium in asymmetric autocatalysis of pyrimidyl alkanol.","Chemical communications (Cambridge, England)","2021","57","85","11209","11212","10.1039/d1cc04206h","","","0.71073","MoKα","","0.0506","0.0405","","","0.091","0.0948","","","","","","1.025","","","","has coordinates","270387","2021-11-06","18:54:59",""
"7129069","10.823","0.005","13.099","0.006","14.027","0.007","66.034","0.005","78.752","0.006","67.832","0.005","1680.8","1.4","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C60 H110 N4 O4 Zn5 -","- C60 H110 N4 O4 Zn5 -","- C60 H110 N4 O4 Zn5 -","1","0.5","","Matsumoto, Arimasa; Tanaka, Ayame; Kaimori, Yoshiyasu; Hara, Natsuki; Mikata, Yuji; Soai, Kenso","Circular dichroism spectroscopy of catalyst preequilibrium in asymmetric autocatalysis of pyrimidyl alkanol.","Chemical communications (Cambridge, England)","2021","57","85","11209","11212","10.1039/d1cc04206h","","","0.71073","MoKα","","0.1326","0.0964","","","0.2662","0.3064","","","","","","1.071","","","","has coordinates,has disorder","270387","2021-11-06","18:55:00",""
"7129070","15.9339","0.0005","11.8086","0.0003","18.6639","0.0005","90","","106.344","0.002","90","","3369.83","0.17","123","2","123","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 Er F8 I N4 O2 -","- C34 H30 Er F8 I N4 O2 -","- C136 H120 Er4 F32 I4 N16 O8 -","4","0.5","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","MoKα","","0.0273","0.0205","","","0.0423","0.0445","","","","","","1.015","","","","has coordinates","270395","2021-11-06","18:58:51",""
"7129071","12.8662","0.0009","9.495","0.0006","23.738","0.0016","90","","91.727","0.003","90","","2898.6","0.3","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H31 F4 I2 N2 Nd O3 -","- C25 H31 F4 I2 N2 Nd O3 -","- C100 H124 F16 I8 N8 Nd4 O12 -","4","1","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","MoKα","","0.017","0.0153","","","0.0315","0.032","","","","","","1.117","","","","has coordinates","270395","2021-11-06","18:58:54",""
"7129072","12.811","0.003","9.475","0.0019","23.728","0.005","90","","91.79","0.03","90","","2878.8","1.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H31 F4 Gd I2 N2 O3 -","- C25 H31 F4 Gd I2 N2 O3 -","- C100 H124 F16 Gd4 I8 N8 O12 -","4","1","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","Synchrotron","","0.0358","0.0335","","","0.0791","0.0797","","","","","","1.183","","","","has coordinates","270395","2021-11-06","18:58:54",""
"7129073","15.9539","0.0004","11.8143","0.0003","18.6508","0.0004","90","","106.585","0.001","90","","3369.13","0.14","123","2","123","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 F8 I N4 O2 Tm -","- C34 H30 F8 I N4 O2 Tm -","- C136 H120 F32 I4 N16 O8 Tm4 -","4","0.5","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","MoKα","","0.0187","0.0161","","","0.0362","0.038","","","","","","1.154","","","","has coordinates","270395","2021-11-06","18:58:55",""
"7129074","16.009","0.003","11.879","0.002","18.931","0.004","90","","106.04","0.03","90","","3460","1.3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 F8 Gd I N4 O2 -","- C34 H30 F8 Gd I N4 O2 -","- C136 H120 F32 Gd4 I4 N16 O8 -","4","0.5","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","Synchrotron","","0.0328","0.0323","","","0.0917","0.0921","","","","","","1.103","","","","has coordinates","270395","2021-11-06","18:58:55",""
"7129075","15.937","0.003","11.807","0.002","18.619","0.004","90","","106.55","0.03","90","","3358.4","1.2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 F8 I Lu N4 O2 -","- C34 H30 F8 I Lu N4 O2 -","- C136 H120 F32 I4 Lu4 N16 O8 -","4","0.5","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","Synchrotron","","0.0269","0.0251","","","0.0683","0.0694","","","","","","1.091","","","","has coordinates","270395","2021-11-06","18:58:55",""
"7129076","15.9491","0.0004","11.8365","0.0003","18.7114","0.0006","90","","106.203","0.002","90","","3392.06","0.17","123","2","123.15","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 Dy F8 I N4 O2 -","- C34 H30 Dy F8 I N4 O2 -","- C136 H120 Dy4 F32 I4 N16 O8 -","4","0.5","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","MoKα","","0.0323","0.0225","","","0.0385","0.0413","","","","","","1.07","","","","has coordinates","270395","2021-11-06","18:58:55",""
"7129077","19.141","0.004","10.909","0.002","38.732","0.008","90","","92.82","0.03","90","","8078","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H43 F8 N4 Nd O3 -","- C43 H43 F8 N4 Nd O3 -","- C344 H344 F64 N32 Nd8 O24 -","8","2","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","Synchrotron","","0.0932","0.0802","","","0.2112","0.2256","","","","","","1.056","","","","has coordinates,has disorder","270395","2021-11-06","18:58:55",""
"7129078","18.997","0.003","18.997","0.003","43.447","0.009","90","","90","","120","","13579","4","100","2","100","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C25 H35 Eu I2 N3 O2.5 -","- C25 H35 Eu I2 N3 O2.5 -","- C450 H630 Eu18 I36 N54 O45 -","18","0.5","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","Synchrotron","","0.0421","0.0339","","","0.0962","0.1009","","","","","","1.063","","","","has coordinates,has disorder","270395","2021-11-06","18:58:55",""
"7129079","15.929","0.003","11.845","0.002","18.679","0.004","90","","106.19","0.03","90","","3384.6","1.2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 F8 Ho I N4 O2 -","- C34 H30 F8 Ho I N4 O2 -","- C136 H120 F32 Ho4 I4 N16 O8 -","4","0.5","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","Synchrotron","","0.0203","0.0201","","","0.0504","0.0505","","","","","","1.102","","","","has coordinates","270395","2021-11-06","18:58:55",""
"7129080","11.6323","0.0003","13.4896","0.0003","16.2376","0.0005","99.391","0.002","106.182","0.003","97.937","0.002","2368.45","0.12","122.99","0.1","122.99","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C45 H75 I2 Lu N2 O5 -","- C45 H75 I2 Lu N2 O5 -","- C90 H150 I4 Lu2 N4 O10 -","2","1","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","x-ray","0.71073","MoKα","","0.0632","0.0492","","","0.1282","0.1391","","","","","","1.062","","","","has coordinates,has disorder","270395","2021-11-06","18:58:55",""
"7129081","19.6958","0.0003","18.9803","0.0003","24.0171","0.0005","90","","90","","90","","8978.4","0.3","123","2","123","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C41 H67 I2 N2 Nd O4 -","- C41 H67 I2 N2 Nd O4 -","- C328 H536 I16 N16 Nd8 O32 -","8","1","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","MoKα","","0.045","0.0309","","","0.0691","0.075","","","","","","1.071","","","","has coordinates,has disorder","270395","2021-11-06","18:58:55",""
"7129082","9.623","0.0019","23.486","0.005","12.883","0.003","90","","92.89","0.03","90","","2907.9","1.1","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H31 F4 I2 N2 O3 Sm -","- C25 H31 F4 I2 N2 O3 Sm -","- C100 H124 F16 I8 N8 O12 Sm4 -","4","1","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","Synchrotron","","0.0288","0.0271","","","0.0679","0.0687","","","","","","1.057","","","","has coordinates","270395","2021-11-06","18:58:55",""
"7129083","18.831","0.004","19.561","0.004","24.134","0.005","90","","90","","90","","8890","3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C41 H67 Gd I2 N2 O4 -","- C41 H67 Gd I2 N2 O4 -","- C328 H536 Gd8 I16 N16 O32 -","8","1","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","Synchrotron","","0.0731","0.0679","","","0.1473","0.149","","","","","","1.137","","","","has coordinates,has disorder","270395","2021-11-06","18:58:55",""
"7129084","12.8569","0.0003","17.2704","0.0004","18.0267","0.0005","90","","107.775","0.001","90","","3811.64","0.17","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H29 Eu F8 N7 -","- C41 H29 Eu F8 N7 -","- C164 H116 Eu4 F32 N28 -","4","0.5","","Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.","Chemical communications (Cambridge, England)","2021","57","87","11513","11516","10.1039/d1cc04080d","","","0.71073","MoKα","","0.0289","0.0229","","","0.0442","0.0464","","","","","","1.058","","","","has coordinates","270395","2021-11-06","18:58:55",""
"7129087","11.2012","0.0004","15.0828","0.0005","15.7471","0.0006","116.793","0.004","107.386","0.003","91.672","0.003","2223.96","0.17","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C41 H27 Cl2 F12 N4 O7 Re S2 -","- C41 H27 Cl2 F12 N4 O7 Re S2 -","- C82 H54 Cl4 F24 N8 O14 Re2 S4 -","2","1","","Leung, Peter Kam-Keung; Lee, Lawrence Cho-Cheung; Ip, Tiffany Ka-Yan; Liu, Hua-Wei; Yiu, Shek-Man; Lee, Nikki P.; Lo, Kenneth Kam-Wing","Luminescent rhenium(I) perfluorobiphenyl complexes as site-specific labels for peptides to afford photofunctional bioconjugates.","Chemical communications (Cambridge, England)","2021","57","85","11256","11259","10.1039/d1cc04740j","","","1.54178","CuKα","","0.036","0.0353","","","0.0912","0.0917","","","","","","1.068","","","","has coordinates","270383","2021-11-06","18:54:25",""
"7129088","36.302","0.004","8.042","0.001","5.3509","0.0006","90","","90","","90","","1562.1","0.3","173","2","173","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C20 H19 N O2 -","- C20 H19 N O2 -","- C80 H76 N4 O8 -","4","1","","Li, Qiao; Cai, Yun; Hu, Yuanyuan; Jin, Hongwei; Chen, Fener; Liu, Yunkui; Zhou, Bingwei","Nickel-catalyzed cyclization of 1,7-enynes for the selective synthesis of dihydrocyclobuta[<i>c</i>]quinolin-3-ones and benzo[<i>b</i>]azocin-2-ones.","Chemical communications (Cambridge, England)","2021","57","88","11657","11660","10.1039/d1cc04750g","","","1.34139","GaKα","","0.0536","0.0424","","","0.1024","0.1113","","","","","","1.061","","","","has coordinates","270347","2021-11-06","18:42:15",""
"7129089","9.1329","0.0004","36.3892","0.0015","10.2426","0.0004","90","","96.38","0.003","90","","3382.9","0.2","173.05","0.1","173.05","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H49 Al N2 O -","- C36 H49 Al N2 O -","- C144 H196 Al4 N8 O4 -","4","1","","Brown, Ryan K.; Hooper, Thomas N.; Rekhroukh, Feriel; White, Andrew J. P.; Costa, Paulo J.; Crimmin, Mark R.","Alumination of aryl methyl ethers: switching between sp<sup>2</sup> and sp<sup>3</sup> C-O bond functionalisation with Pd-catalysis.","Chemical communications (Cambridge, England)","2021","57","88","11673","11676","10.1039/d1cc05408b","","x-ray","0.71073","MoKα","","0.0905","0.0633","","","0.1424","0.162","","","","","","1.088","","","","has coordinates","270408","2021-11-06","19:19:04",""
"7129090","14.1139","0.0008","14.5855","0.0009","18.1458","0.001","82.674","0.005","80.349","0.005","88.508","0.005","3652.5","0.4","173.05","0.1","173.05","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C39 H55 Al N2 O3 -","- C39 H55 Al N2 O3 -","- C156 H220 Al4 N8 O12 -","4","2","","Brown, Ryan K.; Hooper, Thomas N.; Rekhroukh, Feriel; White, Andrew J. P.; Costa, Paulo J.; Crimmin, Mark R.","Alumination of aryl methyl ethers: switching between sp<sup>2</sup> and sp<sup>3</sup> C-O bond functionalisation with Pd-catalysis.","Chemical communications (Cambridge, England)","2021","57","88","11673","11676","10.1039/d1cc05408b","","x-ray","0.71073","MoKα","","0.0742","0.0482","","","0.1172","0.132","","","","","","1.02","","","","has coordinates","270408","2021-11-06","19:19:05",""
"7129091","8.8671","0.0002","22.1194","0.0007","38.8787","0.0011","90","","90","","90","","7625.5","0.4","173","0.14","173","0.14","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C37 H51 Al N2 O2 -","- C37 H51 Al N2 O2 -","- C296 H408 Al8 N16 O16 -","8","1","","Brown, Ryan K.; Hooper, Thomas N.; Rekhroukh, Feriel; White, Andrew J. P.; Costa, Paulo J.; Crimmin, Mark R.","Alumination of aryl methyl ethers: switching between sp<sup>2</sup> and sp<sup>3</sup> C-O bond functionalisation with Pd-catalysis.","Chemical communications (Cambridge, England)","2021","57","88","11673","11676","10.1039/d1cc05408b","","x-ray","0.71073","MoKα","","0.0768","0.0552","","","0.1311","0.1434","","","","","","1.045","","","","has coordinates","270408","2021-11-06","19:19:05",""
"7129092","11.4499","0.0004","18.5015","0.0006","17.1875","0.0005","90","","104.408","0.003","90","","3526.5","0.2","173","0.1","173","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H53 Al N2 O -","- C38 H53 Al N2 O -","- C152 H212 Al4 N8 O4 -","4","1","","Brown, Ryan K.; Hooper, Thomas N.; Rekhroukh, Feriel; White, Andrew J. P.; Costa, Paulo J.; Crimmin, Mark R.","Alumination of aryl methyl ethers: switching between sp<sup>2</sup> and sp<sup>3</sup> C-O bond functionalisation with Pd-catalysis.","Chemical communications (Cambridge, England)","2021","57","88","11673","11676","10.1039/d1cc05408b","","x-ray","0.71073","MoKα","","0.0699","0.048","","","0.1113","0.1237","","","","","","1.019","","","","has coordinates","270408","2021-11-06","19:19:05",""
"7129093","17.6433","0.0003","20.3069","0.0003","18.5103","0.0003","90","","95.838","0.002","90","","6597.49","0.18","173","3","173","3","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H49 Al N2 O -","- C36 H49 Al N2 O -","- C288 H392 Al8 N16 O8 -","8","1","","Brown, Ryan K.; Hooper, Thomas N.; Rekhroukh, Feriel; White, Andrew J. P.; Costa, Paulo J.; Crimmin, Mark R.","Alumination of aryl methyl ethers: switching between sp<sup>2</sup> and sp<sup>3</sup> C-O bond functionalisation with Pd-catalysis.","Chemical communications (Cambridge, England)","2021","57","88","11673","11676","10.1039/d1cc05408b","","x-ray","1.54184","CuKα","","0.0607","0.049","","","0.1325","0.1438","","","","","","1.05","","","","has coordinates","270408","2021-11-06","19:19:05",""
"7129094","7.766","0.0008","15.9828","0.0016","12.3621","0.0012","90","","105.335","0.002","90","","1479.8","0.3","296.15","","296.15","","","","","","","","Roomtemperature","6","P 1 21/c 1","-P 2ybc","14","o-I-BDP","o-I-BDP","","- C15 H10 B F2 I N2 -","- C15 H10 B F2 I N2 -","- C60 H40 B4 F8 I4 N8 -","4","1","","Feng, Siyang; Qu, Zhirong; Zhou, Zhikuan; Chen, Jiaying; Gai, Lizhi; Lu, Hua","Si-Bridged annulated BODIPYs: synthesis, unique structure and photophysical properties.","Chemical communications (Cambridge, England)","2021","57","88","11689","11692","10.1039/d1cc04687j","","","0.71073","MoKα","","0.053","0.0371","","","0.0857","0.0939","","","","","","1.037","","","","has coordinates","270407","2021-11-06","19:05:20",""
"7129095","9.515","0.003","10.803","0.004","11.632","0.004","103.385","0.006","102.11","0.006","95.597","0.006","1123.8","0.7","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C27 H19 B F2 N2 Si -","- C27 H19 B F2 N2 Si -","- C54 H38 B2 F4 N4 Si2 -","2","1","","Feng, Siyang; Qu, Zhirong; Zhou, Zhikuan; Chen, Jiaying; Gai, Lizhi; Lu, Hua","Si-Bridged annulated BODIPYs: synthesis, unique structure and photophysical properties.","Chemical communications (Cambridge, England)","2021","57","88","11689","11692","10.1039/d1cc04687j","","","","","","0.068","","","","","","","","","","","","","","","has coordinates","270407","2021-11-06","19:05:21",""
"7129096","10.1352","0.0003","18.7726","0.0005","15.8738","0.0005","90","","103.95","0.003","90","","2931.14","0.15","297.1","0.5","297.1","0.5","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H20 N2 O2 -","- C17 H20 N2 O2 -","- C136 H160 N16 O16 -","8","2","","Chen, Xiangtao; Yu, Lei; Wang, Huijing; Zhang, Wen; Tang, Pei; Chen, Fener","Stereoselective total synthesis of (±)-vindeburnol and (±)-16-<i>epi</i>-vindeburnol.","Chemical communications (Cambridge, England)","2021","57","88","11669","11672","10.1039/d1cc04980a","","x-ray","1.54184","CuKα","","0.0654","0.0565","","","0.1488","0.1611","","","","","","1.028","","","","has coordinates","270406","2021-11-06","19:05:10",""
"7129097","10.047","0.0002","11.2058","0.00019","13.1505","0.0003","90","","101.241","0.002","90","","1452.14","0.05","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H20 N2 O2 -","- C17 H20 N2 O2 -","- C68 H80 N8 O8 -","4","1","","Chen, Xiangtao; Yu, Lei; Wang, Huijing; Zhang, Wen; Tang, Pei; Chen, Fener","Stereoselective total synthesis of (±)-vindeburnol and (±)-16-<i>epi</i>-vindeburnol.","Chemical communications (Cambridge, England)","2021","57","88","11669","11672","10.1039/d1cc04980a","","","1.54184","CuKα","","0.0711","0.0648","","","0.1612","0.171","","","","","","1.06","","","","has coordinates","270406","2021-11-06","19:05:11",""
"7129098","6.52889","0.00015","26.9565","0.0006","9.50589","0.00019","90","","104.117","0.002","90","","1622.47","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 N2 O2 -","- C17 H20 N2 O2 -","- C68 H80 N8 O8 -","4","1","","Chen, Xiangtao; Yu, Lei; Wang, Huijing; Zhang, Wen; Tang, Pei; Chen, Fener","Stereoselective total synthesis of (±)-vindeburnol and (±)-16-<i>epi</i>-vindeburnol.","Chemical communications (Cambridge, England)","2021","57","88","11669","11672","10.1039/d1cc04980a","","","1.54184","CuKα","","0.0585","0.0533","","","0.1467","0.1525","","","","","","1.062","","","","has coordinates","270406","2021-11-06","19:05:11",""
"7129099","9.1512","0.0014","10.0552","0.0016","11.032","0.002","79.734","0.007","81.052","0.008","74.73","0.008","957.3","0.3","93","2","93","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H20 Si -","- C26 H20 Si -","- C52 H40 Si2 -","2","1","","Ito, Shotaro; Ishii, Youichi; Ishimura, Kazuya; Kuwabara, Takuya","A new strategy for hyperconjugative antiaromatic compounds utilizing negative charges: a dibenzo[<i>b</i>,<i>f</i>]silepinyl dianion.","Chemical communications (Cambridge, England)","2021","57","86","11330","11333","10.1039/d1cc04434f","","","0.71075","MoKα","","0.0673","0.045","","","0.1012","0.111","","","","","","1.009","","","","has coordinates","270349","2021-11-06","18:44:52",""
"7129100","8.9514","0.0018","19.204","0.004","11.397","0.002","90","","98.546","0.004","90","","1937.4","0.7","93","2","93","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 Si -","- C26 H22 Si -","- C104 H88 Si4 -","4","1","","Ito, Shotaro; Ishii, Youichi; Ishimura, Kazuya; Kuwabara, Takuya","A new strategy for hyperconjugative antiaromatic compounds utilizing negative charges: a dibenzo[<i>b</i>,<i>f</i>]silepinyl dianion.","Chemical communications (Cambridge, England)","2021","57","86","11330","11333","10.1039/d1cc04434f","","","0.71075","MoKα","","0.1038","0.0665","","","0.1366","0.1568","","","","","","1.048","","","","has coordinates","270349","2021-11-06","18:44:52",""
"7129101","10.6771","0.0012","23.008","0.002","16.8602","0.0018","90","","98.541","0.002","90","","4095.9","0.7","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H60 Li2 O5 Si -","- C46 H60 Li2 O5 Si -","- C184 H240 Li8 O20 Si4 -","4","1","","Ito, Shotaro; Ishii, Youichi; Ishimura, Kazuya; Kuwabara, Takuya","A new strategy for hyperconjugative antiaromatic compounds utilizing negative charges: a dibenzo[<i>b</i>,<i>f</i>]silepinyl dianion.","Chemical communications (Cambridge, England)","2021","57","86","11330","11333","10.1039/d1cc04434f","","","0.71075","MoKα","","0.0595","0.0494","","","0.1199","0.1285","","","","","","1.053","","","","has coordinates,has disorder","270349","2021-11-06","18:44:52",""
"7129102","8.7954","0.0013","19.899","0.003","13.0118","0.0018","90","","108.107","0.016","90","","2164.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 N2 O4 S -","- C24 H20 N2 O4 S -","- C96 H80 N8 O16 S4 -","4","1","","Li, Rui-Li; Fang, Qing-Yun; Li, Mei-Yuan; Wang, Xiang-Shan; Zhao, Li-Ming","A rearrangement of saccharin-derived cyclic ketimines with 3-chlorooxindoles leading to spiro-1,3-benzothiazine oxindoles.","Chemical communications (Cambridge, England)","2021","57","86","11322","11325","10.1039/d1cc04179g","","x-ray","0.71073","MoKα","","0.1297","0.0675","","","0.1257","0.1544","","","","","","1.027","","","","has coordinates","270348","2021-11-06","18:44:41",""
"7129103","11.3994","0.0008","10.3299","0.0008","20.9886","0.0015","90","","97.981","0.001","90","","2447.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H26 N2 O4 -","- C29 H26 N2 O4 -","- C116 H104 N8 O16 -","4","1","","Tang, Shi; Ding, Shumin; Li, Dan; Li, Lianjie; Zhao, Haixia; Chai, Minxue; Wang, Jian","Palladium-catalysed imidoylative spirocyclization of 3-(2-isocyanoethyl)indoles.","Chemical communications (Cambridge, England)","2021","57","81","10576","10579","10.1039/d1cc03240b","","","0.71073","MoKα","","0.0874","0.0676","","","0.1863","0.2006","","","","","","1.069","","","","has coordinates","269921","2021-10-13","22:07:23",""
"7129104","8.4101","0.0002","11.1055","0.0003","25.7204","0.0007","90","","93.86","0.002","90","","2396.79","0.11","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 N2 O6 -","- C26 H26 N2 O6 -","- C104 H104 N8 O24 -","4","1","","Tang, Shi; Ding, Shumin; Li, Dan; Li, Lianjie; Zhao, Haixia; Chai, Minxue; Wang, Jian","Palladium-catalysed imidoylative spirocyclization of 3-(2-isocyanoethyl)indoles.","Chemical communications (Cambridge, England)","2021","57","81","10576","10579","10.1039/d1cc03240b","","","1.54178","CuKα","","0.0844","0.0723","","","0.2024","0.2179","","","","","","1.051","","","","has coordinates","269921","2021-10-13","22:07:23",""
"7129105","8.3815","0.0002","7.1324","0.0001","10.0251","0.0002","90","","103.832","0.001","90","","581.92","0.02","200","2","200","2","","","","","","","","4","P 1 21 1","P 2yb","4","RR-626-F1_200K","","","- C12 H13 Br O3 -","- C12 H13 Br O3 -","- C24 H26 Br2 O6 -","2","1","","Del Río-Rodríguez, Roberto; Laina-Martín, Víctor; Fernández-Salas, Jose A; Alemán, José","Enantioselective vinylogous Mukaiyama aldol reaction of α-ketoesters under bifunctional organocatalysis.","Chemical communications (Cambridge, England)","2021","57","88","11665","11668","10.1039/d1cc04263g","","","0.71073","MoKα","","0.0195","0.0183","","","0.0462","0.0547","","","","","","1.183","","","","has coordinates","270346","2021-11-06","18:36:18",""
"7129106","11.4679","0.0011","3.8858","0.0004","24.813","0.003","90","","95.936","0.01","90","","1099.8","0.2","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 Br N3 -","- C13 H10 Br N3 -","- C52 H40 Br4 N12 -","4","1","","Taylor, Lauren L. K.; Vitorica-Yrezabal, Iñigo J; Borilović, Ivana; Tuna, Floriana; Riddell, Imogen A.","Self-assembly of a trigonal bipyramidal architecture with stabilisation of iron in three spin states.","Chemical communications (Cambridge, England)","2021","57","85","11252","11255","10.1039/d1cc04413c","","x-ray","0.71073","MoKα","","0.1171","0.0696","","","0.1151","0.1324","","","","","","1.063","","","","has coordinates","270380","2021-11-06","18:53:26",""
"7129107","10.5589","0.0007","14.5471","0.0009","21.514","0.0012","71.694","0.005","81.751","0.005","70.445","0.006","2953.7","0.3","100","0.2","100","","","","","","","","","7","P -1","-P 1","2","","IR-LT-020(3L1M)","","- C61.62 H49.07 B2 F7.84 Fe N14.07 O3 -","- C61.626 H49.074 B2 F7.84 Fe N14.073 O3 -","- C123.252 H98.148 B4 F15.68 Fe2 N28.146 O6 -","2","1","","Taylor, Lauren L. K.; Vitorica-Yrezabal, Iñigo J; Borilović, Ivana; Tuna, Floriana; Riddell, Imogen A.","Self-assembly of a trigonal bipyramidal architecture with stabilisation of iron in three spin states.","Chemical communications (Cambridge, England)","2021","57","85","11252","11255","10.1039/d1cc04413c","","","0.71073","MoKα","","0.1325","0.0896","","","0.23","0.2558","","","","","","1.058","","","","has coordinates,has disorder","270380","2021-11-06","18:53:29",""
"7129108","8.3959","0.0014","10.4913","0.0017","10.5635","0.0018","75.42","0.014","86.542","0.013","79.753","0.014","886","0.3","150","0.3","150","0.3","","","","","","","","5","P -1","-P 1","2","","AIR3","","- C20.62 H19.53 Br0.05 N3.96 O1.9 -","- C20.6256 H19.532 Br0.0468 N3.9532 O1.9064 -","- C41.2512 H39.064 Br0.0936 N7.9064 O3.8128 -","2","1","","Taylor, Lauren L. K.; Vitorica-Yrezabal, Iñigo J; Borilović, Ivana; Tuna, Floriana; Riddell, Imogen A.","Self-assembly of a trigonal bipyramidal architecture with stabilisation of iron in three spin states.","Chemical communications (Cambridge, England)","2021","57","85","11252","11255","10.1039/d1cc04413c","","x-ray","0.71073","MoKα","","0.1154","0.0797","","","0.1992","0.2417","","","","","","1.068","","","","has coordinates,has disorder","270380","2021-11-06","18:53:29",""
"7129109","15.105","0.003","15.136","0.002","19.131","0.003","73.976","0.013","70.124","0.014","60.931","0.019","3562.4","1.2","150","0.1","150","","","","","","","","","6","P -1","-P 1","2","","1","","- C63 H54 B2 F8 Fe N16 -","- C63 H54 B2 F8 Fe N16 -","- C126 H108 B4 F16 Fe2 N32 -","2","1","","Taylor, Lauren L. K.; Vitorica-Yrezabal, Iñigo J; Borilović, Ivana; Tuna, Floriana; Riddell, Imogen A.","Self-assembly of a trigonal bipyramidal architecture with stabilisation of iron in three spin states.","Chemical communications (Cambridge, England)","2021","57","85","11252","11255","10.1039/d1cc04413c","","","1.54184","CuKα","","0.178","0.0955","","","0.2538","0.3085","","","","","","0.94","","","","has coordinates","270380","2021-11-06","18:53:29",""
"7129110","26.433","0.002","26.433","0.002","22.1827","0.0013","90","","90","","120","","13422.6","1.6","100","","100","","","","","","","","","6","P 31 2 1","P 31 2""","152","","IR-LT-020(9.28)","","- C126 H108 B7 F34 Fe6 N32 -","- C126 H108 B7 F34 Fe6 N32 -","- C378 H324 B21 F102 Fe18 N96 -","3","0.5","","Taylor, Lauren L. K.; Vitorica-Yrezabal, Iñigo J; Borilović, Ivana; Tuna, Floriana; Riddell, Imogen A.","Self-assembly of a trigonal bipyramidal architecture with stabilisation of iron in three spin states.","Chemical communications (Cambridge, England)","2021","57","85","11252","11255","10.1039/d1cc04413c","","","0.6889","synchrotron","","0.1397","0.1094","","","0.2905","0.3273","","","","","","1.277","","","","has coordinates,has disorder","270380","2021-11-06","18:53:29",""
"7129111","7.2185","0.0006","8.4349","0.0007","13.3131","0.0007","73.182","0.006","87.767","0.006","68.261","0.008","718.62","0.11","100","","100","","","","","","","","","4","P -1","-P 1","2","","IR-LT-ligand","","- C19 H14 N4 O -","- C19 H14 N4 O -","- C38 H28 N8 O2 -","2","1","","Taylor, Lauren L. K.; Vitorica-Yrezabal, Iñigo J; Borilović, Ivana; Tuna, Floriana; Riddell, Imogen A.","Self-assembly of a trigonal bipyramidal architecture with stabilisation of iron in three spin states.","Chemical communications (Cambridge, England)","2021","57","85","11252","11255","10.1039/d1cc04413c","","x-ray","0.6889","Synchrotron","","0.1111","0.0735","","","0.1884","0.2089","","","","","","0.976","","","","has coordinates","270380","2021-11-06","18:53:29",""
"7129112","26.679","0.003","26.679","0.003","21.8284","0.0011","90","","90","","120","","13455","2","100","","100","","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C126 H108 B7 F34 Fe6 N32 -","- C126 H108 B7 F34 Fe6 N32 -","- C378 H324 B21 F102 Fe18 N96 -","3","0.5","","Taylor, Lauren L. K.; Vitorica-Yrezabal, Iñigo J; Borilović, Ivana; Tuna, Floriana; Riddell, Imogen A.","Self-assembly of a trigonal bipyramidal architecture with stabilisation of iron in three spin states.","Chemical communications (Cambridge, England)","2021","57","85","11252","11255","10.1039/d1cc04413c","","","0.6889","synchrotron","","0.1572","0.0789","","","0.2135","0.2678","","","","","","0.969","","","","has coordinates,has disorder","270380","2021-11-06","18:53:29",""
"7129113","11.4085","0.0004","14.0475","0.0006","10.6955","0.0004","90","","102.008","0.002","90","","1676.56","0.11","300","","300","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","In-zijing","","- C26 H32 Cl7 In N4 O4 -","- C26 H32 Cl7 In N4 O4 -","- C52 H64 Cl14 In2 N8 O8 -","2","0.5","","Pan, Qiu-Yue; Sun, Meng-En; Zhang, Chong; Li, Lin-Ke; Liu, Hua-Li; Li, Kai-Jie; Li, Hai-Yang; Zang, Shuang-Quan","A multi-responsive indium-viologen hybrid with ultrafast-response photochromism and electrochromism.","Chemical communications (Cambridge, England)","2021","57","86","11394","11397","10.1039/d1cc05070b","","","0.71073","MoKα","","0.0757","0.072","","","0.1885","0.1899","","","","","","1.308","","","","has coordinates,has disorder","270351","2021-11-06","18:45:08",""
"7129117","5.1221","0.0002","14.0899","0.0005","18.2239","0.0006","90","","90","","90","","1315.22","0.08","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 F N O3 -","- C14 H16 F N O3 -","- C56 H64 F4 N4 O12 -","4","1","","Zhou, Jianrong Steve; Guo, Siyu; Zhao, Xiaohu; Chi, Yonggui Robin","Nickel-catalyzed enantioselective umpolung hydrogenation for stereoselective synthesis of β-amido esters.","Chemical communications (Cambridge, England)","2021","57","87","11501","11504","10.1039/d1cc05257h","","","1.54178","CuKα","","0.0444","0.041","","","0.1062","0.1105","","","","","","1.062","","","","has coordinates","270396","2021-11-06","18:59:04",""
"7129122","10.32987","0.00014","14.773","0.0002","20.5303","0.0003","90","","99.0954","0.0013","90","","3093.6","0.08","140","0.1","140","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H36 Cl N2 O3 Rh -","- C31 H36 Cl N2 O3 Rh -","- C124 H144 Cl4 N8 O12 Rh4 -","4","1","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.0322","0.0278","","","0.066","0.0683","","","","","","1.044","","","","has coordinates","270399","2021-11-06","19:00:07",""
"7129123","21.7877","0.0002","12.66021","0.00012","37.743","0.0004","90","","99.9129","0.001","90","","10255.5","0.18","140","0.1","140","0.1","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C58 H72 N4 O2 -","- C58 H72 N4 O2 -","- C464 H576 N32 O16 -","8","1","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.0525","0.0448","","","0.1164","0.1232","","","","","","1.029","","","","has coordinates,has disorder","270399","2021-11-06","19:00:07",""
"7129124","6.2198","0.0003","15.0126","0.0007","7.3727","0.0003","90","","96.876","0.004","90","","683.48","0.05","140","0.1","140","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 N2 O -","- C7 H8 N2 O -","- C28 H32 N8 O4 -","4","1","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.0372","0.0321","","","0.0849","0.0891","","","","","","1.068","","","","has coordinates","270399","2021-11-06","19:00:07",""
"7129125","8.2887","0.0003","12.5359","0.0004","16.8607","0.0005","86.331","0.003","82.998","0.003","86.923","0.003","1733.44","0.1","140","0.1","140","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C38 H47 Cl N2 O Pd -","- C38 H47 Cl N2 O Pd -","- C76 H94 Cl2 N4 O2 Pd2 -","2","1","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.0339","0.029","","","0.0637","0.0685","","","","","","1.104","","","","has coordinates,has disorder","270399","2021-11-06","19:00:07",""
"7129126","20.58217","0.00016","16.76993","0.00007","20.98706","0.00016","90","","114.727","0.0009","90","","6579.73","0.09","140","0.1","140","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H48 N2 O2 -","- C38 H48 N2 O2 -","- C304 H384 N16 O16 -","8","2","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.0441","0.0391","","","0.0982","0.1017","","","","","","1.027","","","","has coordinates","270399","2021-11-06","19:00:07",""
"7129127","9.28771","0.00011","13.5951","0.0002","15.3562","0.0003","90","","90.79","0.0015","90","","1938.8","0.05","140","0.1","140","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 N2 O -","- C23 H24 N2 O -","- C92 H96 N8 O4 -","4","1","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.0489","0.0385","","","0.1019","0.1086","","","","","","1.016","","","","has coordinates","270399","2021-11-06","19:00:07",""
"7129128","16.825","0.0004","8.93762","0.00018","21.4865","0.0004","90","","108.212","0.002","90","","3069.19","0.12","140","0.1","140.15","","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C29 H36 N2 O -","- C29 H36 N2 O -","- C116 H144 N8 O4 -","4","0.5","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","","1.54184","CuKα","","0.0493","0.0379","","","0.1002","0.1035","","","","","","0.996","","","","has coordinates,has disorder","270399","2021-11-06","19:00:07",""
"7129129","8.29535","0.00012","10.67345","0.00016","36.5755","0.0005","90","","92.092","0.0011","90","","3236.24","0.08","140","0.1","140","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H36 N2 S5 -","- C31 H36 N2 S5 -","- C124 H144 N8 S20 -","4","1","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.0356","0.0321","","","0.0806","0.0832","","","","","","1.028","","","","has coordinates,has disorder","270399","2021-11-06","19:00:07",""
"7129130","24.5239","0.0007","29.6444","0.0009","16.5867","0.0005","90","","95.752","0.003","90","","11997.8","0.6","140","0.1","140","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C59 H75 Br0.47 Cl2.53 N4 O2 -","- C59 H75 Br0.471 Cl2.529 N4 O2 -","- C472 H600 Br3.768 Cl20.232 N32 O16 -","8","2","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.1362","0.0727","","","0.1748","0.2142","","","","","","0.996","","","","has coordinates,has disorder","270399","2021-11-06","19:00:07",""
"7129131","11.8074","0.0004","16.1835","0.0006","16.625","0.0007","62.421","0.004","83.645","0.003","82.289","0.003","2786.1","0.2","140","0.1","140","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C30 H40 N2 O2 -","- C30 H40 N2 O2 -","- C120 H160 N8 O8 -","4","2","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.0739","0.0523","","","0.1407","0.1521","","","","","","0.995","","","","has coordinates,has disorder","270399","2021-11-06","19:00:07",""
"7129132","10.39335","0.00014","19.4815","0.0002","16.5164","0.0002","90","","100.79","0.0013","90","","3285.08","0.07","140","0.1","140","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32.5 H39.5 Cl3 Ga N2 O -","- C32.5 H39.5 Cl3 Ga N2 O -","- C130 H158 Cl12 Ga4 N8 O4 -","4","1","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.0397","0.032","","","0.0826","0.0877","","","","","","1.03","","","","has coordinates,has disorder","270399","2021-11-06","19:00:07",""
"7129133","20.61099","0.00013","12.54486","0.00009","10.50093","0.00007","90","","90","","90","","2715.14","0.03","140","0.1","140","0.1","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C29 H36 Au Cl N2 O -","- C29 H36 Au Cl N2 O -","- C116 H144 Au4 Cl4 N8 O4 -","4","1","","Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay","Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.","Chemical communications (Cambridge, England)","2021","57","87","11509","11512","10.1039/d1cc05161j","","x-ray","1.54184","CuKα","","0.0309","0.0309","","","0.0827","0.0827","","","","","","1.099","","","","has coordinates","270399","2021-11-06","19:00:07",""
"7129135","10.7066","0.0013","7.5896","0.0008","7.8261","0.0008","90","","110.158","0.013","90","","596.99","0.12","100","0.11","100","0.11","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Ba F4 Fe I O3 -","- Ba F4 Fe I O3 -","- Ba4 F16 Fe4 I4 O12 -","4","1","","Huang, Qian-Ming; Hu, Chun-Li; Yang, Bing-Ping; Fang, Zhi; Huang, Yu; Mao, Jiang-Gao","Ba<sub>2</sub>[FeF<sub>4</sub>(IO<sub>3</sub>)<sub>2</sub>]IO<sub>3</sub>: a promising nonlinear optical material achieved by chemical-tailoring-induced structure evolution.","Chemical communications (Cambridge, England)","2021","57","87","11525","11528","10.1039/d1cc04462a","","x-ray","0.71073","MoKα","","0.0511","0.038","","","0.0727","0.0813","","","","","","1.035","","","","has coordinates","270394","2021-11-06","18:57:31",""
"7129136","13.7239","0.0008","11.4384","0.0008","7.4518","0.0006","90","","90","","90","","1169.78","0.14","99.98","0.15","99.98","0.15","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- Ba2 F4 Fe I3 O9 -","- Ba2 F4 Fe I3 O9 -","- Ba8 F16 Fe4 I12 O36 -","4","1","","Huang, Qian-Ming; Hu, Chun-Li; Yang, Bing-Ping; Fang, Zhi; Huang, Yu; Mao, Jiang-Gao","Ba<sub>2</sub>[FeF<sub>4</sub>(IO<sub>3</sub>)<sub>2</sub>]IO<sub>3</sub>: a promising nonlinear optical material achieved by chemical-tailoring-induced structure evolution.","Chemical communications (Cambridge, England)","2021","57","87","11525","11528","10.1039/d1cc04462a","","x-ray","0.71073","MoKα","","0.0409","0.0345","","","0.0734","0.0776","","","","","","1.031","","","","has coordinates","270394","2021-11-06","18:57:31",""
"7129137","19.0236","0.0009","32.8188","0.0016","18.0034","0.0009","90","","94.183","0.002","90","","11210.2","0.9","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C114 H82 Cl6 N24 O8 -","- C114 H82 Cl6 N24 O8 -","- C456 H328 Cl24 N96 O32 -","4","0.5","","Wang, Zhen; Yang, Bin-Bin; Fang, Zi-Jun; Ou, Qiang; Ma, Hui; Zhang, Qing-Pu; Sun, Yu-Ling; Zhang, Chun","Emissive oxidase-like nanozyme based on an organic molecular cage.","Chemical communications (Cambridge, England)","2021","57","87","11541","11544","10.1039/d1cc04430c","","","1.34138","GaKα","","0.0935","0.0818","","","0.255","0.2705","","","","","","1.071","","","","has coordinates","270397","2021-11-06","18:59:21",""
"7129138","18.802","0.0002","33.0495","0.0003","17.858","0.0001","90","","93.173","0.001","90","","11079.9","0.17","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C11 H10 N O -","- C9.33333 H6.66667 N2 O0.666667 -","- C448 H320 N96 O32 -","48","6","","Wang, Zhen; Yang, Bin-Bin; Fang, Zi-Jun; Ou, Qiang; Ma, Hui; Zhang, Qing-Pu; Sun, Yu-Ling; Zhang, Chun","Emissive oxidase-like nanozyme based on an organic molecular cage.","Chemical communications (Cambridge, England)","2021","57","87","11541","11544","10.1039/d1cc04430c","","","1.54184","CuKα","","0.1711","0.1625","","","0.478","0.4934","","","","","","2.43","","","","has coordinates","270397","2021-11-06","18:59:22",""
"7129181","14.2718","0.0007","6.581","0.0003","24.714","0.003","90","","90.107","0.007","90","","2321.2","0.3","140","0.1","140","0.1","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C42 H26 K2 N18 Na4 O13 -","- C42 H26 K2 N18 Na4 O13 -","- C84 H52 K4 N36 Na8 O26 -","2","0.5","","Landman, Iris R.; Fadaei-Tirani, Farzaneh; Severin, Kay","Nitrous oxide as a diazo transfer reagent: the synthesis of triazolopyridines.","Chemical communications (Cambridge, England)","2021","57","87","11537","11540","10.1039/d1cc04907k","","x-ray","1.54184","CuKα","","0.1061","0.0634","","","0.1545","0.1704","","","","","","1.042","","","","has coordinates","270211","2021-11-02","22:56:41",""
"7129193","8.9929","0.0008","9.622","0.001","17.0576","0.0019","90","","90","","90","","1476","0.3","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H18 N2 O2 -","- C17 H18 N2 O2 -","- C68 H72 N8 O8 -","4","1","","Biswas, Subhamoy; Porashar, Bikoshita; Arandhara, Pallav Jyoti; Saikia, Anil K.","Synthesis of pyrimido[2,1-<i>a</i>]isoindolone and isoindolo[2,1-<i>a</i>]quinazolinone <i>via</i> intramolecular aza-Prins type reaction.","Chemical communications (Cambridge, England)","2021","57","88","11701","11704","10.1039/d1cc04554g","","","0.71073","MoKα","","0.0512","0.0426","","","0.1245","0.1334","","","","","","0.866","","","","has coordinates","270300","2021-11-04","14:10:01",""
"7129194","9.5567","0.0006","9.7212","0.0006","15.0352","0.0009","90","","93.695","0.002","90","","1393.91","0.15","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C68 H56 N8 O8 -","4","1","","Biswas, Subhamoy; Porashar, Bikoshita; Arandhara, Pallav Jyoti; Saikia, Anil K.","Synthesis of pyrimido[2,1-<i>a</i>]isoindolone and isoindolo[2,1-<i>a</i>]quinazolinone <i>via</i> intramolecular aza-Prins type reaction.","Chemical communications (Cambridge, England)","2021","57","88","11701","11704","10.1039/d1cc04554g","","","0.71073","MoKα","","0.08","0.0499","","","0.1424","0.1768","","","","","","1.048","","","","has coordinates","270300","2021-11-04","14:10:02",""
"7129195","15.5642","0.0002","21.6386","0.0003","30.8946","0.0003","90","","90.903","0.001","90","","10403.6","0.2","130","","130","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","macro1","","- C103 H148 F6 N7 O25 P -","- C103 H148 F6 N7 O25 P -","- C412 H592 F24 N28 O100 P4 -","4","1","","Sobiech, Thomas A.; Zhong, Yulong; Sánchez B, Laura S; Kauffmann, Brice; McGrath, Jillian K.; Scalzo, Christina; Miller, Daniel P.; Huc, Ivan; Zurek, Eva; Ferrand, Yann; Gong, Bing","Stable pseudo[3]rotaxanes with strong positive binding cooperativity based on shape-persistent aromatic oligoamide macrocycles.","Chemical communications (Cambridge, England)","2021","57","88","11645","11648","10.1039/d1cc05193h","","","1.54178","CuKα","","0.1575","0.1334","","","0.4125","0.4392","","","","","","1.917","","","","has coordinates","270301","2021-11-04","14:13:26",""
"7129196","11.0219","0.0001","22.6904","0.0001","19.9096","0.0001","90","","105.642","0.001","90","","4794.81","0.06","85","2","85","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C53 H47 B Cl2 F4 Ir N3 O2 P2 -","- C53 H47 B Cl2 F4 Ir N3 O2 P2 -","- C212 H188 B4 Cl8 F16 Ir4 N12 O8 P8 -","4","1","","Shanahan, J. P.; Moore, C. M.; Kampf, Jeff W.; Szymczak, N. K.","Modulation of H<sup>+</sup>/H<sup>-</sup> exchange in iridium-hydride 2-hydroxypyridine complexes by remote Lewis acids.","Chemical communications (Cambridge, England)","2021","57","88","11705","11708","10.1039/d1cc04778g","","","1.54184","CuKα","","0.0363","0.0362","","","0.097","0.097","","","","","","1.133","","","","has coordinates,has disorder","270302","2021-11-04","14:36:31",""
"7129197","15.63118","0.00007","23.44856","0.0001","14.12898","0.00008","90","","90","","90","","5178.68","0.04","85","2","85","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C59 H62 B Ir N3 O4 P2 -","- C59 H62 B Ir N3 O4 P2 -","- C236 H248 B4 Ir4 N12 O16 P8 -","4","0.5","","Shanahan, J. P.; Moore, C. M.; Kampf, Jeff W.; Szymczak, N. K.","Modulation of H<sup>+</sup>/H<sup>-</sup> exchange in iridium-hydride 2-hydroxypyridine complexes by remote Lewis acids.","Chemical communications (Cambridge, England)","2021","57","88","11705","11708","10.1039/d1cc04778g","","","1.54184","CuKα","","0.0357","0.0355","","","0.092","0.0921","","","","","","1.06","","","","has coordinates,has disorder","270302","2021-11-04","14:36:32",""
"7129198","15.0726","0.0004","19.6116","0.0006","20.9592","0.0006","74.069","0.003","71.86","0.002","80.182","0.002","5636.9","0.3","85","2","85","2","","","","","","","","9","P -1","-P 1","2","","","","- C122.5 H102 Cl2 F10 Ir2 N6 O4 P4 Zn2 -","- C122.5 H102 Cl2 F10 Ir2 N6 O4 P4 Zn2 -","- C245 H204 Cl4 F20 Ir4 N12 O8 P8 Zn4 -","2","1","","Shanahan, J. P.; Moore, C. M.; Kampf, Jeff W.; Szymczak, N. K.","Modulation of H<sup>+</sup>/H<sup>-</sup> exchange in iridium-hydride 2-hydroxypyridine complexes by remote Lewis acids.","Chemical communications (Cambridge, England)","2021","57","88","11705","11708","10.1039/d1cc04778g","","","1.54184","CuKα","","0.0628","0.0559","","","0.1529","0.1629","","","","","","1.017","","","","has coordinates,has disorder","270302","2021-11-04","14:36:32",""
"7129199","15.951","0.0001","27.4111","0.0002","23.7638","0.0001","90","","103.551","0.001","90","","10101.1","0.11","85","2","85","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C53.75 H48.5 Cl1.5 Ir N3 O2.5 P2 -","- C53.75 H48.5 Cl1.5 Ir N3 O2.5 P2 -","- C430 H388 Cl12 Ir8 N24 O20 P16 -","8","2","","Shanahan, J. P.; Moore, C. M.; Kampf, Jeff W.; Szymczak, N. K.","Modulation of H<sup>+</sup>/H<sup>-</sup> exchange in iridium-hydride 2-hydroxypyridine complexes by remote Lewis acids.","Chemical communications (Cambridge, England)","2021","57","88","11705","11708","10.1039/d1cc04778g","","","1.54184","CuKα","","0.055","0.0485","","","0.1341","0.1406","","","","","","1.039","","","","has coordinates,has disorder","270302","2021-11-04","14:36:32",""
"7129217","9.9491","0.0003","8.2942","0.0002","11.528","0.0004","90","","111.243","0.004","90","","886.65","0.05","293","2","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H19 Cl N2 O -","- C21 H19 Cl N2 O -","- C42 H38 Cl2 N4 O2 -","2","1","","Wang, Guanghui; Jia, Jian; Liu, Gang; Yu, Mingwu; Chu, Xiaoxiao; Liu, Xiguang; Zhao, Ximei","Copper(I)-catalyzed tandem synthesis of 2-acylquinolines from 2-ethynylanilines and glyoxals.","Chemical communications (Cambridge, England)","2021","57","89","11811","11814","10.1039/d1cc05612c","","x-ray","1.54184","CuKα","","0.0295","0.0286","","","0.0723","0.0727","","","","","","1.086","","","","has coordinates","270544","2021-11-09","22:57:27",""