# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-07T04:02:51+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Organic Chemistry Frontiers') AND volume = 6 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
"1554403","5.5091","0.0007","7.2665","0.0008","16.992","0.002","80.823","0.005","83.934","0.004","78.863","0.004","656.9","0.14","99","2","99","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H18 N2 O S -","- C14 H18 N2 O S -","- C28 H36 N4 O2 S2 -","2","1","","Dutta, Soumya; Mondal, Manas; Ghosh, Tubai; Saha, Amit","Unprecedented thiocarbamidation of nitroarenes: a facile one-pot route to unsymmetrical thioureas","Organic Chemistry Frontiers","2019","6","1","70","","10.1039/C8QO00752G","","","0.71073","MoKα","","0.1205","0.1014","","","0.2704","0.2926","","","","","","1.091","","","","has coordinates","237196","2020-10-21","18:00:00",""
"1554419","15.853","0.003","12.375","0.002","7.3639","0.0012","90","","90","","90","","1444.7","0.4","296","2","296","2","","","","","","","","2","P n a 21","P 2c -2n","33","","","","- C20 H18 -","- C20 H18 -","- C80 H72 -","4","1","","Muthuramalingam, Somasundaram; Garg, Jai Anand; Karthick, R.; Fox, Thomas; Blacque, Olivier; Venkatesan, Koushik; Ramanathan, Saiganesh; Kabilan, Senthamaraikannan; Balasubramanian, K. K.","Nickel catalyzed synthesis of 4,4′-bichromenes/4,4′-bithiochromenes and their Atropisomerism","Organic Chemistry Frontiers","2019","6","1","134","","10.1039/C8QO00820E","","","0.71073","MoKα","","0.0757","0.0456","","","0.0892","0.1032","","","","","","1.011","","","","has coordinates","237221","2020-10-21","18:00:00",""
"1554420","8.0844","0.0004","19.8817","0.001","10.2123","0.0005","90","","109.061","0.002","90","","1551.44","0.13","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H14 O4 -","- C20 H14 O4 -","- C80 H56 O16 -","4","1","","Muthuramalingam, Somasundaram; Garg, Jai Anand; Karthick, R.; Fox, Thomas; Blacque, Olivier; Venkatesan, Koushik; Ramanathan, Saiganesh; Kabilan, Senthamaraikannan; Balasubramanian, K. K.","Nickel catalyzed synthesis of 4,4′-bichromenes/4,4′-bithiochromenes and their Atropisomerism","Organic Chemistry Frontiers","2019","6","1","134","","10.1039/C8QO00820E","","","0.71073","MoKα","","0.0722","0.0486","","","0.1072","0.1218","","","","","","0.988","","","","has coordinates","237221","2020-10-21","18:00:00",""
"1554437","9.1009","0.0001","17.5658","0.0002","8.1862","0.0001","90","","103.294","0.001","90","","1273.61","0.03","296","1","296","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 4-hydroxy-7-methoxy-2-(methylthio)quinoline-3-carboxylate","","- C13 H13 N O4 S -","- C13 H13 N O4 S -","- C52 H52 N4 O16 S4 -","4","1","","Kang, On-Yu; Park, Seong Jun; Ahn, Hyojung; Jeong, Kyung Chae; Lim, Hwan Jung","Structural assignment of the enol‒keto tautomers of one-pot synthesized 4-hydroxyquinolines/4-quinolones","Organic Chemistry Frontiers","2019","6","2","183","","10.1039/C8QO00884A","","","0.71073","MoKα","","0.0726","0.0558","","","0.1285","0.1368","","","","","","1.079","","","","has coordinates","237237","2020-10-21","18:00:00",""
"1554438","7.2268","0.0003","9.0737","0.0004","10.4696","0.0004","80.813","0.002","84.674","0.002","88.958","0.003","674.8","0.05","296","1","296","1","","","","","","","","5","P -1","-P 1","2","","Methyl 8-methoxy-2-(methylthio)-4-oxo-1,4-dihydroquinoline-3-carboxylate","","- C13 H15 N O5 S -","- C13 H15 N O5 S -","- C26 H30 N2 O10 S2 -","2","1","","Kang, On-Yu; Park, Seong Jun; Ahn, Hyojung; Jeong, Kyung Chae; Lim, Hwan Jung","Structural assignment of the enol‒keto tautomers of one-pot synthesized 4-hydroxyquinolines/4-quinolones","Organic Chemistry Frontiers","2019","6","2","183","","10.1039/C8QO00884A","","","0.71073","MoKα","","0.0589","0.0511","","","0.1476","0.1552","","","","","","1.054","","","","has coordinates","237237","2020-10-21","18:00:00",""
"1554439","7.2412","0.0009","9.7236","0.0012","11.4552","0.0015","85.64","0.006","87.406","0.006","77.183","0.006","783.86","0.17","296","1","296","1","","","","","","","","5","P -1","-P 1","2","","Methyl 8-methoxy-2-(methylsulfinyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate","","- C13 H19 N O8 S -","- C13 H19 N O8 S -","- C26 H38 N2 O16 S2 -","2","1","","Kang, On-Yu; Park, Seong Jun; Ahn, Hyojung; Jeong, Kyung Chae; Lim, Hwan Jung","Structural assignment of the enol‒keto tautomers of one-pot synthesized 4-hydroxyquinolines/4-quinolones","Organic Chemistry Frontiers","2019","6","2","183","","10.1039/C8QO00884A","","","0.71073","MoKα","","0.0509","0.0429","","","0.1227","0.1289","","","","","","1.077","","","","has coordinates","237237","2020-10-21","18:00:00",""
"1554440","6.6266","0.0006","18.2993","0.0015","11.8645","0.001","90","","99.67","0.006","90","","1418.3","0.2","296","1","296","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 5-methoxy-2-(methylsulfinyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate","","- C16 H13 N O5 S -","- C16 H13 N O5 S -","- C64 H52 N4 O20 S4 -","4","1","","Kang, On-Yu; Park, Seong Jun; Ahn, Hyojung; Jeong, Kyung Chae; Lim, Hwan Jung","Structural assignment of the enol‒keto tautomers of one-pot synthesized 4-hydroxyquinolines/4-quinolones","Organic Chemistry Frontiers","2019","6","2","183","","10.1039/C8QO00884A","","","0.71073","MoKα","","0.0963","0.0785","","","0.2396","0.2512","","","","","","1.103","","","","has coordinates","237237","2020-10-21","18:00:00",""
"1554446","10.9778","0.0007","16.148","0.001","17.5888","0.0011","90","","106.231","0.0016","90","","2993.7","0.3","230","2","230","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H44 N3 P2 Rh -","- C31 H44 N3 P2 Rh -","- C124 H176 N12 P8 Rh4 -","4","1","","Zhou, Chunhui; Hu, Jinsong; Wang, Yuan; Yao, Changguang; Chakraborty, Priyanka; Li, Huaifeng; Guan, Chao; Huang, Mei-Hui; Huang, Kuo-Wei","Selective carbonylation of benzene to benzaldehyde using a phosphorus‒nitrogen PN3P‒rhodium(i) complex","Organic Chemistry Frontiers","2019","6","6","721","","10.1039/C8QO00892B","","","1.54178","CuKα","","0.0345","0.0339","","","0.0932","0.0937","","","","","","1.047","","","","has coordinates,has disorder","237242","2020-10-21","18:00:00",""
"1554447","29.2408","0.0009","13.8295","0.0004","25.4214","0.0007","90","","120.925","0.001","90","","8818.6","0.5","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C92 H120 N6 O3 P4 Rh2 -","- C92 H120 N6 O3 P4 Rh2 -","- C368 H480 N24 O12 P16 Rh8 -","4","0.5","","Zhou, Chunhui; Hu, Jinsong; Wang, Yuan; Yao, Changguang; Chakraborty, Priyanka; Li, Huaifeng; Guan, Chao; Huang, Mei-Hui; Huang, Kuo-Wei","Selective carbonylation of benzene to benzaldehyde using a phosphorus‒nitrogen PN3P‒rhodium(i) complex","Organic Chemistry Frontiers","2019","6","6","721","","10.1039/C8QO00892B","","","1.54178","CuKα","","0.0288","0.0276","","","0.0752","0.0763","","","","","","1.015","","","","has coordinates","237242","2020-10-21","18:00:00",""
"1554449","12.2395","0.0019","14.363","0.002","18.399","0.003","89.442","0.003","89.312","0.002","88.419","0.003","3232.9","0.9","296","2","296.15","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H37 I N2 Ru -","- C30 H37 I N2 Ru -","- C120 H148 I4 N8 Ru4 -","4","2","","Wu, Xuan-Jun; Wang, Hua-Jing; Yang, Zhao-Qi; Tang, Xiao-Sheng; Yuan, Ye; Su, Wei; Chen, Cheng; Verpoort, Francis","Efficient and phosphine-free bidentate N-heterocyclic carbene/ruthenium catalytic systems for the dehydrogenative amidation of alcohols and amines","Organic Chemistry Frontiers","2019","6","5","563","","10.1039/C8QO00902C","","","0.71073","MoKα","","0.0941","0.0641","","","0.1851","0.2175","","","","","","1.002","","","","has coordinates","237246","2020-10-21","18:00:00",""
"1554450","15.329","0.002","7.7727","0.001","21.254","0.003","90","","95.269","0.002","90","","2521.7","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H31 I N2 Ru -","- C27 H31 I N2 Ru -","- C108 H124 I4 N8 Ru4 -","4","1","","Wu, Xuan-Jun; Wang, Hua-Jing; Yang, Zhao-Qi; Tang, Xiao-Sheng; Yuan, Ye; Su, Wei; Chen, Cheng; Verpoort, Francis","Efficient and phosphine-free bidentate N-heterocyclic carbene/ruthenium catalytic systems for the dehydrogenative amidation of alcohols and amines","Organic Chemistry Frontiers","2019","6","5","563","","10.1039/C8QO00902C","","","0.71073","MoKα","","0.0375","0.0299","","","0.0729","0.0763","","","","","","1.036","","","","has coordinates","237246","2020-10-21","18:00:00",""
"1554463","8.892","0.012","9.668","0.01","13.91","0.02","86.33","0.05","86.29","0.04","67.91","0.04","1105","2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H25 N O3 S -","- C27 H25 N O3 S -","- C54 H50 N2 O6 S2 -","2","1","","Beltran, Frédéric; Andna, Lucile; Miesch, Laurence","Spirocyclization of keto-ynesulfonamides promoted by quaternary ammonium salts","Organic Chemistry Frontiers","2019","6","3","373","","10.1039/C8QO00937F","","","0.71073","MoKα","","0.0862","0.0477","","","0.1076","0.1226","","","","","","1.029","","","","has coordinates","237254","2020-10-21","18:00:00",""
"1554464","7.6023","0.0004","7.8229","0.0004","16.7412","0.0009","85.307","0.002","84.129","0.002","85.07","0.002","984.06","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H25 N O3 S -","- C22 H25 N O3 S -","- C44 H50 N2 O6 S2 -","2","1","","Beltran, Frédéric; Andna, Lucile; Miesch, Laurence","Spirocyclization of keto-ynesulfonamides promoted by quaternary ammonium salts","Organic Chemistry Frontiers","2019","6","3","373","","10.1039/C8QO00937F","","","0.71073","MoKα","","0.0583","0.0456","","","0.1183","0.1267","","","","","","1.001","","","","has coordinates","237254","2020-10-21","18:00:00",""
"1554465","10.5059","0.0006","11.5524","0.0005","19.3292","0.0009","90","","99.812","0.002","90","","2311.6","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H27 N O3 S -","- C28 H27 N O3 S -","- C112 H108 N4 O12 S4 -","4","1","","Beltran, Frédéric; Andna, Lucile; Miesch, Laurence","Spirocyclization of keto-ynesulfonamides promoted by quaternary ammonium salts","Organic Chemistry Frontiers","2019","6","3","373","","10.1039/C8QO00937F","","","0.71073","MoKα","","0.0784","0.0505","","","0.1215","0.1379","","","","","","1.035","","","","has coordinates","237254","2020-10-21","18:00:00",""
"1554466","8.6751","0.0005","21.9074","0.0013","12.355","0.0005","90","","107.893","0.001","90","","2234.5","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H29 N O3 S -","- C25 H29 N O3 S -","- C100 H116 N4 O12 S4 -","4","1","","Beltran, Frédéric; Andna, Lucile; Miesch, Laurence","Spirocyclization of keto-ynesulfonamides promoted by quaternary ammonium salts","Organic Chemistry Frontiers","2019","6","3","373","","10.1039/C8QO00937F","","","0.71073","MoKα","","0.0905","0.0654","","","0.1575","0.1784","","","","","","1.012","","","","has coordinates","237254","2020-10-21","18:00:00",""
"1554485","6.1036","0.0004","12.5506","0.0007","21.976","0.0013","90","","90","","90","","1683.45","0.18","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H24 O5 -","- C20 H24 O5 -","- C80 H96 O20 -","4","1","","Yang, Qian; Hu, Kun; Yan, Bing-Chao; Liu, Miao; Li, Xiao-Nian; Sun, Han-Dong; Puno, Pema-Tenzin","Maoeriocalysins A‒D, four novel ent-kaurane diterpenoids from Isodon eriocalyx and their structure determination utilizing quantum chemical calculation in conjunction with quantitative interproton distance analysis","Organic Chemistry Frontiers","2019","6","1","45","","10.1039/C8QO01007B","","","1.54178","CuKα","","0.0356","0.0353","","","0.0939","0.0942","","","","","","1.072","","","","has coordinates","237272","2020-10-21","18:00:00",""
"1554489","7.4865","0.0008","11.7277","0.0013","20.913","0.003","90","","90","","90","","1836.1","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C10 H8 F N3 -","- C10 H8 F N3 -","- C80 H64 F8 N24 -","8","1","","Zhao, Mingzhu; Cai, Juewang; Zhao, Xiaoming","Silver-promoted selective fluorination of 2-aminopyrimidines: synthesis of 5-fluoro-2-aminopyrimidine derivatives","Organic Chemistry Frontiers","2019","6","4","426","","10.1039/C8QO01054D","","","0.71073","MoKα","","0.0552","0.0436","","","0.0997","0.108","","","","","","1.106","","","","has coordinates","237278","2020-10-21","18:00:00",""
"1554490","8.4745","0.0007","13.483","0.0013","12.5515","0.0012","90","","96.566","0.003","90","","1424.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 F N5 O2 -","- C16 H12 F N5 O2 -","- C64 H48 F4 N20 O8 -","4","1","","Zhao, Mingzhu; Cai, Juewang; Zhao, Xiaoming","Silver-promoted selective fluorination of 2-aminopyrimidines: synthesis of 5-fluoro-2-aminopyrimidine derivatives","Organic Chemistry Frontiers","2019","6","4","426","","10.1039/C8QO01054D","","","0.71073","MoKα","","0.0581","0.0443","","","0.1115","0.1196","","","","","","1.046","","","","has coordinates","237278","2020-10-21","18:00:00",""
"1554491","6.185","0.002","7.487","0.002","18.728","0.006","90","","96.138","0.011","90","","862.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H8 F N3 -","- C9 H7 F N4 -","- C36 H28 F4 N16 -","4","1","","Zhao, Mingzhu; Cai, Juewang; Zhao, Xiaoming","Silver-promoted selective fluorination of 2-aminopyrimidines: synthesis of 5-fluoro-2-aminopyrimidine derivatives","Organic Chemistry Frontiers","2019","6","4","426","","10.1039/C8QO01054D","","","0.71073","MoKα","","0.0746","0.0546","","","0.1129","0.1211","","","","","","1.05","","","","has coordinates","237278","2020-10-21","18:00:00",""
"1554492","27.38","0.03","26.9","0.03","24.03","0.03","90","","90","","90","","17699","4","296","2","296","2","","","","","","","","6","A e a 2","A 2 -2ab","41","","","","- C70 H56 Ag5 Cl2 N6 P4 -","- C70 H56 Ag5 Cl2 N6 P4 -","- C560 H448 Ag40 Cl16 N48 P32 -","8","1","","Zhao, Mingzhu; Cai, Juewang; Zhao, Xiaoming","Silver-promoted selective fluorination of 2-aminopyrimidines: synthesis of 5-fluoro-2-aminopyrimidine derivatives","Organic Chemistry Frontiers","2019","6","4","426","","10.1039/C8QO01054D","","","0.71073","MoKα","","0.0794","0.0647","","","0.1672","0.1826","","","","","","1.112","","","","has coordinates,has disorder","237278","2020-10-21","18:00:00",""
"1554493","3.9188","0.0004","12.5127","0.0013","15.3057","0.0015","101.08","0.005","96.416","0.005","92.665","0.005","730.13","0.13","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H14 N2 -","- C20 H14 N2 -","- C40 H28 N4 -","2","1","","Chang, Yu-Che; Prakash, Sekar; Cheng, Chien-Hong","ReI-Catalyzed highly regio- and stereoselective C‒H addition to terminal and internal alkynes","Organic Chemistry Frontiers","2019","6","4","432","","10.1039/C8QO01068D","","","0.71073","MoKα","","0.0531","0.0459","","","0.1268","0.1325","","","","","","1.064","","","","has coordinates","237282","2020-10-21","18:00:00",""
"1554494","10.5762","0.0007","7.8869","0.0006","19.9879","0.0016","90","","91.535","0.003","90","","1666.7","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H19 N3 -","- C22 H19 N3 -","- C88 H76 N12 -","4","1","","Chang, Yu-Che; Prakash, Sekar; Cheng, Chien-Hong","ReI-Catalyzed highly regio- and stereoselective C‒H addition to terminal and internal alkynes","Organic Chemistry Frontiers","2019","6","4","432","","10.1039/C8QO01068D","","","0.71073","MoKα","","0.048","0.0377","","","0.0832","0.0897","","","","","","1.05","","","","has coordinates","237282","2020-10-21","18:00:00",""
"1554495","9.1577","0.0009","10.7173","0.0007","13.3021","0.001","106.893","0.003","91.497","0.004","91.349","0.003","1248.12","0.18","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H20 N4 O2 -","- C25 H20 N4 O2 -","- C50 H40 N8 O4 -","2","1","","Chang, Yu-Che; Prakash, Sekar; Cheng, Chien-Hong","ReI-Catalyzed highly regio- and stereoselective C‒H addition to terminal and internal alkynes","Organic Chemistry Frontiers","2019","6","4","432","","10.1039/C8QO01068D","","","0.71073","MoKα","","0.1257","0.1087","","","0.2187","0.2278","","","","","","1.101","","","","has coordinates","237282","2020-10-21","18:00:00",""
"1554496","8.5256","0.0003","16.9053","0.0005","8.9274","0.0003","90","","112.31","0.004","90","","1190.37","0.08","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H25 N O3 -","- C30 H25 N O3 -","- C60 H50 N2 O6 -","2","1","","Xu, Jianfeng; Peng, Jingyi; He, Chonglong; Ren, Hongjun","N-Heterocyclic carbene catalyzed chemo- and enantioselective cross-benzoin reaction of aldehydes with isatins","Organic Chemistry Frontiers","2019","6","2","172","","10.1039/C8QO01085D","","","1.54184","CuKα","","0.0359","0.0348","","","0.0962","0.0974","","","","","","1.045","","","","has coordinates","237284","2020-10-21","18:00:00",""
"1554497","12.268","0.002","8.6753","0.0017","37.965","0.007","90","","92.878","0.003","90","","4035.5","1.3","273.15","","273.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H12 Cl3 O P S3 -","- C18 H12 Cl3 O P S3 -","- C144 H96 Cl24 O8 P8 S24 -","8","1","","Lu, Guozhang; Chen, Jun; Huangfu, Xinlei; Li, Xueyan; Fang, Meijuan; Tang, Guo; Zhao, Yufen","Visible-light-mediated direct synthesis of phosphorotrithioates as potent anti-inflammatory agents from white phosphorus","Organic Chemistry Frontiers","2019","6","2","190","","10.1039/C8QO01087K","","","0.71073","MoKα","","0.0596","0.0534","","","0.1351","0.139","","","","","","1.148","","","","has coordinates","237286","2020-10-21","18:00:00",""
"1554498","25.2058","0.0019","7.2704","0.0006","19.2306","0.0015","90","","105.306","0.002","90","","3399.1","0.5","100","","100","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C38 H42 Cl2 O7 -","- C38 H42 Cl2 O7 -","- C152 H168 Cl8 O28 -","4","1","","Fan, Jian-Hong; Hu, Ya-Jian; Guo, Qiang; Li, Shaoping; Zhao, Jing; Li, Chuang-Chuang","Asymmetric synthesis of the tetracyclic core of bufogargarizin C by an intramolecular [5 + 2] cycloaddition","Organic Chemistry Frontiers","2019","6","1","22","","10.1039/C8QO01089G","","x-ray","0.71073","MoKα","","0.0433","0.0408","","","0.0936","0.0945","","","","","","1.107","","","","has coordinates","237288","2020-10-21","18:00:00",""
"1554499","7.8836","0.0005","12.2399","0.0008","11.1988","0.0008","90","","90.174","0.002","90","","1080.62","0.13","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H22 N O2 P -","- C27 H22 N O2 P -","- C54 H44 N2 O4 P2 -","2","1","","Zhang, Dong-Liang; Li, Cheng-Kun; Zeng, Run-Sheng; Shoberu, Adedamola; Zou, Jian-Ping","Manganese(iii)-mediated selective phosphorylation of enamides: direct synthesis of β-phosphoryl enamides","Organic Chemistry Frontiers","2019","6","2","236","","10.1039/C8QO01098F","","","0.71073","MoKα","","0.0275","0.0269","","","0.0732","0.0738","","","","","","1.026","","","","has coordinates","237291","2020-10-21","18:00:00",""
"1554500","6.0253","0.0006","9.0011","0.0009","10.3679","0.0011","75.005","0.003","76.437","0.003","89.09","0.003","527.4","0.09","120","2","120","2","","","","","","","","5","P 1","P 1","1","","","","- C27 H22 N O2 P -","- C27 H22 N O2 P -","- C27 H22 N O2 P -","1","1","","Zhang, Dong-Liang; Li, Cheng-Kun; Zeng, Run-Sheng; Shoberu, Adedamola; Zou, Jian-Ping","Manganese(iii)-mediated selective phosphorylation of enamides: direct synthesis of β-phosphoryl enamides","Organic Chemistry Frontiers","2019","6","2","236","","10.1039/C8QO01098F","","","0.71073","MoKα","","0.0488","0.0427","","","0.085","0.0879","","","","","","1.067","","","","has coordinates","237291","2020-10-21","18:00:00",""
"1554501","23.47","0.002","9.9387","0.0006","17.2934","0.0012","90","","123.484","0.007","90","","3364.4","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H15 F3 O4 -","- C19 H15 F3 O4 -","- C152 H120 F24 O32 -","8","1","","Chen, Yueji; You, Yi; Weng, Zhiqiang","Syntheses of 2-(2,2,2-trifluoroethylidene)/(2,2-difluoroethyl)-1,3-dicarbonyl compounds and their fungicidal activities","Organic Chemistry Frontiers","2019","6","2","213","","10.1039/C8QO01118D","","","0.71073","MoKα","","0.0537","0.0407","","","0.1194","0.1456","","","","","","1.13","","","","has coordinates","237293","2020-10-21","18:00:00",""
"1554502","13.7491","0.0016","5.8303","0.0005","21.42","0.003","90","","105.814","0.012","90","","1652.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H12 Br2 F2 O2 -","- C17 H12 Br2 F2 O2 -","- C68 H48 Br8 F8 O8 -","4","1","","Chen, Yueji; You, Yi; Weng, Zhiqiang","Syntheses of 2-(2,2,2-trifluoroethylidene)/(2,2-difluoroethyl)-1,3-dicarbonyl compounds and their fungicidal activities","Organic Chemistry Frontiers","2019","6","2","213","","10.1039/C8QO01118D","","","0.71073","MoKα","","0.1837","0.0882","","","0.1408","0.1687","","","","","","1.017","","","","has coordinates","237293","2020-10-21","18:00:00",""
"1554503","21.2879","0.0007","7.5138","0.0004","11.5723","0.0006","90","","90","","90","","1851.02","0.15","100","2","100","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C22 H21 N O5 -","- C22 H21 N O5 -","- C88 H84 N4 O20 -","4","1","","Shoji, Taku; Araki, Takanori; Iida, Nanami; Miura, Kota; Ohta, Akira; Sekiguchi, Ryuta; Ito, Shunji; Okujima, Tetsuo","Synthesis of azulenophthalimides by phosphine-mediated annulation of 1,2-diformylazulenes with maleimides","Organic Chemistry Frontiers","2019","6","2","195","","10.1039/C8QO01121D","","","0.71075","MoKα","","0.0612","0.0492","","","0.1036","0.1087","","","","","","1.028","","","","has coordinates","237295","2020-10-21","18:00:00",""
"1554504","25.2081","0.0012","25.2081","0.0012","30.11","0.0016","90","","90","","120","","16570","1.4","101","2","101","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C68 H68 Cl6 N4 O10 P2 -","- C68 H68 Cl6 N4 O10 P2 -","- C612 H612 Cl54 N36 O90 P18 -","9","0.5","","Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan","Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts","Organic Chemistry Frontiers","2019","6","1","110","","10.1039/C8QO01122B","","","1.54178","CuKα","","0.0688","0.0656","","","0.1913","0.1949","","","","","","0.996","","","","has coordinates,has disorder","237297","2020-10-21","18:00:00",""
"1554505","19.7346","0.0013","19.9943","0.0012","14.9829","0.0007","90","","110.36","0.002","90","","5542.6","0.6","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C66 H66 I N2 O4 P2 -","- C66 H66 I N2 O4 P2 -","- C264 H264 I4 N8 O16 P8 -","4","0.5","","Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan","Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts","Organic Chemistry Frontiers","2019","6","1","110","","10.1039/C8QO01122B","","","0.71073","MoKα","","0.0664","0.0566","","","0.1493","0.1555","","","","","","1.039","","","","has coordinates,has disorder","237297","2020-10-21","18:00:00",""
"1554506","10.967","0.0006","15.8648","0.001","20.3172","0.0011","90","","105.084","0.003","90","","3413.2","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H34 Br Cl3 N O2 P -","- C34 H34 Br Cl3 N O2 P -","- C136 H136 Br4 Cl12 N4 O8 P4 -","4","1","","Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan","Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts","Organic Chemistry Frontiers","2019","6","1","110","","10.1039/C8QO01122B","","","1.54178","CuKα","","0.0818","0.063","","","0.1632","0.1801","","","","","","1.042","","","","has coordinates,has disorder","237297","2020-10-21","18:00:00",""
"1554507","19.664","0.0005","19.9512","0.0006","15.5025","0.0004","90","","111.125","0.001","90","","5673.2","0.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C66 H66 F6 N2 O4 P3 -","- C66 H66 F6 N2 O4 P3 -","- C264 H264 F24 N8 O16 P12 -","4","0.5","","Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan","Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts","Organic Chemistry Frontiers","2019","6","1","110","","10.1039/C8QO01122B","","","1.54178","CuKα","","0.0587","0.0565","","","0.154","0.1587","","","","","","1.066","","","","has coordinates,has disorder","237297","2020-10-21","18:00:00",""
"1554508","24.8062","0.0009","24.8062","0.0009","30.0418","0.0011","90","","90","","120","","16009.5","1","100","2","100","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C66 H66 Cl N2 O7.33 P2 -","- C66 H66 Cl1.00013 N2 O7.33333 P2 -","- C594 H594 Cl9.0012 N18 O66 P18 -","9","0.5","","Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan","Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts","Organic Chemistry Frontiers","2019","6","1","110","","10.1039/C8QO01122B","","","1.54178","CuKα","","0.1453","0.1377","","","0.4022","0.4169","","","","","","2.015","","","","has coordinates,has disorder","237297","2020-10-21","18:00:00",""
"1554509","15.5817","0.0005","20.6208","0.0006","22.0566","0.0007","90","","90","","90","","7086.9","0.4","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C74 H86 F12 N2 O6 P4 -","- C74 H86 F12 N2 O6 P4 -","- C296 H344 F48 N8 O24 P16 -","4","0.5","","Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan","Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts","Organic Chemistry Frontiers","2019","6","1","110","","10.1039/C8QO01122B","","","1.54178","CuKα","","0.1075","0.1029","","","0.2711","0.2756","","","","","","1.046","","","","has coordinates,has disorder","237297","2020-10-21","18:00:00",""
"1554510","14.2234","0.0009","15.5567","0.0011","12.5242","0.0008","90","","108.744","0.002","90","","2624.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C66 H66 N2 O4 P2 -","- C66 H66 N2 O4 P2 -","- C132 H132 N4 O8 P4 -","2","0.5","","Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan","Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts","Organic Chemistry Frontiers","2019","6","1","110","","10.1039/C8QO01122B","","","1.54178","CuKα","","0.0775","0.0711","","","0.2076","0.2176","","","","","","1.119","","","","has coordinates,has disorder","237297","2020-10-21","18:00:00",""
"1554511","24.7543","0.0007","24.7543","0.0007","30.0212","0.0009","90","","90","","120","","15931.6","0.8","100","","99.99","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C66 H66 Br N2 O4 P2 -","- C66 H66 Br0.990667 N2 O4 P2 -","- C594 H594 Br8.916 N18 O36 P18 -","9","0.5","","Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan","Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts","Organic Chemistry Frontiers","2019","6","1","110","","10.1039/C8QO01122B","","","1.54184","CuKα","","0.1455","0.1345","","","0.3998","0.4175","","","","","","2.005","","","","has coordinates","237297","2020-10-21","18:00:00",""
"1554512","6.3585","0.0005","10.945","0.0011","17.5672","0.0013","90","","92.051","0.007","90","","1221.78","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H17 N S -","- C12 H17 N S -","- C48 H68 N4 S4 -","4","1","","Lai, Miao; Wu, Zhiyong; Wang, Yizhi; Zheng, Ying; Zhao, Mingqin","Selective synthesis of aryl thioamides and aryl-α-ketoamides from α-oxocarboxylic acids and tetraalkylthiuram disulfides: an unexpected chemoselectivity from aryl sulfonyl chlorides","Organic Chemistry Frontiers","2019","6","4","506","","10.1039/C8QO01127C","","x-ray","1.54184","CuKα","","0.076","0.0566","","","0.1577","0.1751","","","","","","1.039","","","","has coordinates,has disorder","237299","2020-10-21","18:00:00",""
"1554513","10.687","0.008","12.035","0.009","14.902","0.011","90","","90","","90","","1917","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H19 Br O3 -","- C21 H19 Br O3 -","- C84 H76 Br4 O12 -","4","1","","Huang, Huicai; Lu, Xue; Mao, Yukang; Ye, Jinxing","Asymmetric synthesis of highly functionalized furanones via direct Michael reactions mediated by a bulky primary amine","Organic Chemistry Frontiers","2019","6","8","1080","","10.1039/C8QO01132J","","","0.71073","MoKα","","0.0873","0.0517","","","0.1255","0.1398","","","","","","1.008","","","","has coordinates","237301","2020-10-21","18:00:00",""
"1554514","10.4344","0.0002","11.4942","0.0002","11.5277","0.0002","90","","90","","90","","1382.58","0.04","288.3","0.1","288.3","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H20 O3 -","- C17 H20 O3 -","- C68 H80 O12 -","4","1","","Xu, Weici; Li, Yuanzhen; Liu, Rui; Yang, Shuang; Liu, Jian; Fang, Xinqiang","Kinetic resolution of 2,2-disubstituted-1,3-diketones via carbene catalysis","Organic Chemistry Frontiers","2019","6","3","290","","10.1039/C8QO01137K","","","1.54184","CuKα","","0.0333","0.0312","","","0.0783","0.0804","","","","","","1.062","","","","has coordinates","237302","2020-10-21","18:00:00",""
"1554515","8.431","0.0006","8.6965","0.0005","11.7742","0.0005","80.603","0.004","87.055","0.004","65.92","0.006","777.47","0.09","100","0.1","100","0.1","","","","","","","","3","P -1","-P 1","2","","","","- C20 H20 O3 -","- C20 H20 O3 -","- C40 H40 O6 -","2","1","","Xu, Weici; Li, Yuanzhen; Liu, Rui; Yang, Shuang; Liu, Jian; Fang, Xinqiang","Kinetic resolution of 2,2-disubstituted-1,3-diketones via carbene catalysis","Organic Chemistry Frontiers","2019","6","3","290","","10.1039/C8QO01137K","","","1.54184","CuKα","","0.0425","0.0362","","","0.0912","0.0961","","","","","","1.045","","","","has coordinates","237302","2020-10-21","18:00:00",""
"1554516","9.8733","0.0007","10.3877","0.0007","37.781","0.002","90","","96.893","0.006","90","","3846.8","0.4","100","0.6","100","0.6","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H21 F O3 -","- C25 H21 F O3 -","- C200 H168 F8 O24 -","8","2","","Xu, Weici; Li, Yuanzhen; Liu, Rui; Yang, Shuang; Liu, Jian; Fang, Xinqiang","Kinetic resolution of 2,2-disubstituted-1,3-diketones via carbene catalysis","Organic Chemistry Frontiers","2019","6","3","290","","10.1039/C8QO01137K","","","1.54184","CuKα","","0.1466","0.0889","","","0.1572","0.1914","","","","","","1.026","","","","has coordinates","237302","2020-10-21","18:00:00",""
"1554517","23.63","0.002","42.848","0.004","5.8546","0.0005","90","","90","","90","","5927.8","0.9","293","2","293","2","","","","","","","","3","F d d 2","F 2 -2d","43","","","","- C19 H16 O2 -","- C19 H16 O2 -","- C304 H256 O32 -","16","1","","Fan, Jian; Wang, Shengke; Chen, Jiahui; Wu, Manyi; Zhang, Jitan; Xie, Meihua","Synthesis of 2-acetyl trisubstituted furans via copper-mediated deacylation cleavage of unstrained C(sp3)‒C(sp2) bonds","Organic Chemistry Frontiers","2019","6","4","437","","10.1039/C8QO01139G","","","0.71073","MoKα","","0.0497","0.0396","","","0.0922","0.0979","","","","","","1.073","","","","has coordinates","237304","2020-10-21","18:00:00",""
"1554518","10.476","0.011","15.249","0.018","11.317","0.013","90","","116.28","0.03","90","","1621","3","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 O3 -","- C20 H18 O3 -","- C80 H72 O12 -","4","1","","Fan, Jian; Wang, Shengke; Chen, Jiahui; Wu, Manyi; Zhang, Jitan; Xie, Meihua","Synthesis of 2-acetyl trisubstituted furans via copper-mediated deacylation cleavage of unstrained C(sp3)‒C(sp2) bonds","Organic Chemistry Frontiers","2019","6","4","437","","10.1039/C8QO01139G","","","0.71073","MoKα","","0.0851","0.0682","","","0.1841","0.2064","","","","","","1.054","","","","has coordinates,has disorder","237304","2020-10-21","18:00:00",""
"1554519","8.3257","0.0007","15.1988","0.0012","16.3404","0.0013","90","","95.005","0.004","90","","2059.8","0.3","303","2","303","2","","","","","","","","5","I 1 a 1","I -2ya","9","","","","- C23 H21 N O3 S -","- C23 H21 N O3 S -","- C92 H84 N4 O12 S4 -","4","1","","Zhu, Tong-Hao; Zhang, Xiao-Chen; Zhao, Kai; Loh, Teck-Peng","Cu(OTf)2-mediated C(sp2)‒H arylsulfonylation of enamides via the insertion of sulfur dioxide","Organic Chemistry Frontiers","2019","6","1","94","","10.1039/C8QO01144C","","","0.71073","MoKα","","0.0487","0.045","","","0.131","0.1373","","","","","","0.898","","","","has coordinates","237305","2020-10-21","18:00:00",""
"1554520","11.8106","0.0004","12.5767","0.0004","26.9924","0.001","90","","90","","90","","4009.4","0.2","100","0.3","100","0.3","","","","","","","Marine Sponge-Derived Fungus Aspergillus versicolor SCSIO 41016","4","P 21 21 21","P 2ac 2ab","19","(1R,4R)-4-benzyl-1-((S)-sec-butyl)-1-methoxy-1,2-dihydro-6H-pyrazino[2,1-b]quinazoline-3,6(4H)-dione","Brevianamide Y","","- C23 H25 N3 O3 -","- C23 H25 N3 O3 -","- C184 H200 N24 O24 -","8","2","","Luo, Xiaowei; Chen, Chunmei; Tao, Huaming; Lin, Xiuping; Yang, Bin; Zhou, Xuefeng; Liu, Yonghong","Structurally diverse diketopiperazine alkaloids from the marine-derived fungus Aspergillus versicolor SCSIO 41016","Organic Chemistry Frontiers","2019","6","6","736","","10.1039/C8QO01147H","","x-ray","1.54184","CuKα","","0.063","0.0501","","","0.1333","0.1414","","","","","","1.029","","","","has coordinates","277994","2022-09-20","08:32:41",""
"1554521","9.115","0.003","9.448","0.002","11.944","0.003","101.46","0.02","91.031","0.006","106.62","0.007","962.9","0.5","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H23 N2 O3 P -","- C20 H23 N2 O3 P -","- C40 H46 N4 O6 P2 -","2","1","","Yang, Qiaolan; Wu, Chenglin; Zhou, Jianhui; He, Guoxue; Liu, Hong; Zhou, Yu","Highly selective C‒H bond activation of N-arylbenzimidamide and divergent couplings with diazophosphonate compounds: a catalyst-controlled selective synthetic strategy for 3-phosphorylindoles and 4-phosphorylisoquinolines","Organic Chemistry Frontiers","2019","6","3","393","","10.1039/C8QO01148F","","","0.71073","MoKα","","0.0985","0.0841","","","0.2742","0.2831","","","","","","1.17","","","","has coordinates","237309","2020-10-21","18:00:00",""
"1554522","7.6453","0.0019","11.642","0.003","9.808","0.003","90","","102.969","0.008","90","","850.7","0.4","173","","173","","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C18 H20 N O3 P -","- C18 H20 N O3 P -","- C36 H40 N2 O6 P2 -","2","1","","Yang, Qiaolan; Wu, Chenglin; Zhou, Jianhui; He, Guoxue; Liu, Hong; Zhou, Yu","Highly selective C‒H bond activation of N-arylbenzimidamide and divergent couplings with diazophosphonate compounds: a catalyst-controlled selective synthetic strategy for 3-phosphorylindoles and 4-phosphorylisoquinolines","Organic Chemistry Frontiers","2019","6","3","393","","10.1039/C8QO01148F","","","0.71073","MoKα","","0.0904","0.0586","","","0.1416","0.1677","","","","","","0.883","","","","has coordinates","237309","2020-10-21","18:00:00",""
"1554523","27.337","0.003","6.1593","0.0004","20.343","0.002","90","","106.22","0.01","90","","3288.9","0.6","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H40 N6 O12 -","- C30 H36 N6 O12.004 -","- C120 H144 N24 O48.016 -","4","0.5","","Savastano, Matteo; Bazzicalupi, Carla; García-Gallarín, Celeste; López de la Torre, Maria Dolores; Bianchi, Antonio; Melguizo, Manuel","Supramolecular forces and their interplay in stabilizing complexes of organic anions: tuning binding selectivity in water","Organic Chemistry Frontiers","2019","6","1","75","","10.1039/C8QO01152D","","","1.5418","CuKα","","0.0568","0.0466","","","0.1386","0.1599","","","","","","0.807","","","","has coordinates","237310","2020-10-21","18:00:00",""
"1554524","6.8698","0.0001","14.4541","0.0003","14.7842","0.0003","90","","95.204","0.002","90","","1461.97","0.05","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H36 N6 O10 -","- C30 H36 N6 O10 -","- C60 H72 N12 O20 -","2","0.5","","Savastano, Matteo; Bazzicalupi, Carla; García-Gallarín, Celeste; López de la Torre, Maria Dolores; Bianchi, Antonio; Melguizo, Manuel","Supramolecular forces and their interplay in stabilizing complexes of organic anions: tuning binding selectivity in water","Organic Chemistry Frontiers","2019","6","1","75","","10.1039/C8QO01152D","","","1.54184","CuKα","","0.0702","0.0513","","","0.1411","0.1714","","","","","","1.081","","","","has coordinates","237310","2020-10-21","18:00:00",""
"1554525","15.1627","0.0005","6.4915","0.0004","29.4057","0.0009","90","","90","","90","","2894.4","0.2","100","","100","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C26 H38 N6 O9 S2 -","- C26 H38 N6 O9 S2 -","- C104 H152 N24 O36 S8 -","4","1","","Savastano, Matteo; Bazzicalupi, Carla; García-Gallarín, Celeste; López de la Torre, Maria Dolores; Bianchi, Antonio; Melguizo, Manuel","Supramolecular forces and their interplay in stabilizing complexes of organic anions: tuning binding selectivity in water","Organic Chemistry Frontiers","2019","6","1","75","","10.1039/C8QO01152D","","","1.54184","CuKα","","0.0311","0.0287","","","0.0741","0.0755","","","","","","0.973","","","","has coordinates","237310","2020-10-21","18:00:00",""
"1554526","11.4833","0.0006","7.3773","0.0005","13.116","0.0007","90","","96.533","0.004","90","","1103.92","0.11","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H28 N2 O8 -","- C21 H28 N2 O8 -","- C42 H56 N4 O16 -","2","1","","Ma, Qiaoning; Yang, Xiaodi; Lei, Xinsheng; Lin, Guo-Qiang","A highly enantioselective synthetic method towards the α2c-adrenoceptor antagonist ORM-10921","Organic Chemistry Frontiers","2019","6","6","773","","10.1039/C8QO01166D","","","1.54178","CuKα","","0.1605","0.1491","","","0.3396","0.3552","","","","","","1.408","","","","has coordinates","237312","2020-10-21","18:00:00",""
"1554527","6.1903","0.0012","13.744","0.003","32.103","0.006","90","","90","","90","","2731.3","0.9","294","2","294","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H34 Br0 Cl N O4 -","- C32 H34 Cl N O4 -","- C128 H136 Cl4 N4 O16 -","4","1","","Ma, Qiaoning; Yang, Xiaodi; Lei, Xinsheng; Lin, Guo-Qiang","A highly enantioselective synthetic method towards the α2c-adrenoceptor antagonist ORM-10921","Organic Chemistry Frontiers","2019","6","6","773","","10.1039/C8QO01166D","","","1.54178","CuKα","","0.0353","0.034","","","0.0874","0.0887","","","","","","1.062","","","","has coordinates","237312","2020-10-21","18:00:00",""
"1554528","7.976","0.003","8.218","0.003","15.344","0.006","94.059","0.008","104.85","0.007","97.364","0.008","958.5","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C5 H4 F N5 O6 -","- C5 H4 F N5 O6 -","- C20 H16 F4 N20 O24 -","4","2","","Palysaeva, Nadezhda V.; Gladyshkin, Aleksei G.; Vatsadze, Irina A.; Suponitsky, Kyrill Yu.; Dmitriev, Dmitry E.; Sheremetev, Aleksei B.","N-(2-Fluoro-2,2-dinitroethyl)azoles: a novel assembly of diverse explosophoric building blocks for energetic compound design","Organic Chemistry Frontiers","2019","6","2","249","","10.1039/C8QO01173G","","","0.71073","MoKα","","0.0853","0.0448","","","0.0884","0.1034","","","","","","1.009","","","","has coordinates","237313","2020-10-21","18:00:00",""
"1554529","5.4659","0.0012","10.477","0.002","8.1322","0.0017","90","","94.857","0.004","90","","464.03","0.17","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C5 H4 F N5 O6 -","- C5 H4 F N5 O6 -","- C10 H8 F2 N10 O12 -","2","1","","Palysaeva, Nadezhda V.; Gladyshkin, Aleksei G.; Vatsadze, Irina A.; Suponitsky, Kyrill Yu.; Dmitriev, Dmitry E.; Sheremetev, Aleksei B.","N-(2-Fluoro-2,2-dinitroethyl)azoles: a novel assembly of diverse explosophoric building blocks for energetic compound design","Organic Chemistry Frontiers","2019","6","2","249","","10.1039/C8QO01173G","","","0.71073","MoKα","","0.0763","0.0431","","","0.0688","0.0781","","","","","","0.987","","","","has coordinates","237313","2020-10-21","18:00:00",""
"1554530","11.4331","0.0011","5.7212","0.0006","11.2434","0.0011","90","","90","","90","","735.44","0.13","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C3 H3 F N6 O4 -","- C3 H3 F N6 O4 -","- C12 H12 F4 N24 O16 -","4","1","","Palysaeva, Nadezhda V.; Gladyshkin, Aleksei G.; Vatsadze, Irina A.; Suponitsky, Kyrill Yu.; Dmitriev, Dmitry E.; Sheremetev, Aleksei B.","N-(2-Fluoro-2,2-dinitroethyl)azoles: a novel assembly of diverse explosophoric building blocks for energetic compound design","Organic Chemistry Frontiers","2019","6","2","249","","10.1039/C8QO01173G","","","0.71073","MoKα","","0.033","0.0289","","","0.0628","0.0648","","","","","","1.045","","","","has coordinates","237313","2020-10-21","18:00:00",""
"1554531","6.6055","0.0003","11.5186","0.0005","23.4809","0.001","90","","90","","90","","1786.57","0.14","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C5 H4 F N5 O6 -","- C5 H4 F N5 O6 -","- C40 H32 F8 N40 O48 -","8","1","","Palysaeva, Nadezhda V.; Gladyshkin, Aleksei G.; Vatsadze, Irina A.; Suponitsky, Kyrill Yu.; Dmitriev, Dmitry E.; Sheremetev, Aleksei B.","N-(2-Fluoro-2,2-dinitroethyl)azoles: a novel assembly of diverse explosophoric building blocks for energetic compound design","Organic Chemistry Frontiers","2019","6","2","249","","10.1039/C8QO01173G","","","0.71073","MoKα","","0.0368","0.0317","","","0.0837","0.0878","","","","","","1.039","","","","has coordinates","237313","2020-10-21","18:00:00",""
"1554532","14.3845","0.0014","4.3448","0.0004","23.199","0.002","90","","90","","90","","1449.9","0.2","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C19 H15 N O3 -","- C19 H15 N O3 -","- C76 H60 N4 O12 -","4","1","","Wagh, Sachin Bhausaheb; Sharma, Pankaj; Patil, Manoj D.; Liu, Rai-Shung","Gold-catalyzed oxidative cycloalkenations of alkynes with quinoline N-oxides","Organic Chemistry Frontiers","2019","6","2","226","","10.1039/C8QO01175C","","","0.71073","MoKα","","0.051","0.0375","","","0.0747","0.0802","","","","","","1.035","","","","has coordinates","237315","2020-10-21","18:00:00",""
"1554533","21.0827","0.0015","8.2829","0.0006","8.2169","0.0004","90","","95.222","0.002","90","","1428.93","0.16","200","2","200","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C19 H15 N O2 -","- C19 H15 N O2 -","- C76 H60 N4 O8 -","4","2","","Wagh, Sachin Bhausaheb; Sharma, Pankaj; Patil, Manoj D.; Liu, Rai-Shung","Gold-catalyzed oxidative cycloalkenations of alkynes with quinoline N-oxides","Organic Chemistry Frontiers","2019","6","2","226","","10.1039/C8QO01175C","","","0.71073","MoKα","","0.0603","0.0448","","","0.1034","0.1156","","","","","","1.013","","","","has coordinates","237315","2020-10-21","18:00:00",""
"1554534","9.2179","0.0004","10.4777","0.0005","14.2247","0.0007","100.062","0.002","92.031","0.002","103.287","0.002","1312.41","0.11","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H33 Au Cl O2 P -","- C28 H33 Au Cl O2 P -","- C56 H66 Au2 Cl2 O4 P2 -","2","1","","Wagh, Sachin Bhausaheb; Sharma, Pankaj; Patil, Manoj D.; Liu, Rai-Shung","Gold-catalyzed oxidative cycloalkenations of alkynes with quinoline N-oxides","Organic Chemistry Frontiers","2019","6","2","226","","10.1039/C8QO01175C","","","0.71073","MoKα","","0.0196","0.0186","","","0.0442","0.048","","","","","","1.137","","","","has coordinates","237315","2020-10-21","18:00:00",""
"1554535","11.0158","0.0017","12.13","0.0016","23.587","0.003","90","","90","","90","","3151.7","0.8","295.19","0.1","295.19","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H32 Cl N O9 -","- C33 H32 Cl N O9 -","- C132 H128 Cl4 N4 O36 -","4","1","","Cao, Jian; Liu, Jin-Yu; Zhang, Yi-Ming; Wang, Zhu-Yin; Xu, Peng-Fei","Synergistic promotion by intramolecular hydrogen bonding: a bi-functionally catalyzed cascade reaction for the synthesis of enantiopure chromenopyrrolidines","Organic Chemistry Frontiers","2019","6","5","674","","10.1039/C8QO01208C","","","0.71073","MoKα","","0.1754","0.0917","","","0.2117","0.2924","","","","","","0.989","","","","has coordinates","237317","2020-10-21","18:00:00",""
"1554536","7.0667","0.0003","23.0878","0.001","21.9663","0.0007","90","","90","","90","","3583.9","0.2","150.01","0.1","150.01","0.1","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C20 H15 Br2 N O2 -","- C20 H15 Br2 N O2 -","- C160 H120 Br16 N8 O16 -","8","2","","Liu, Zhenhua; Zhu, Guangyu; Gao, Wen; Yang, Lin; Ji, Huimin; Tong, Lili; Tang, Bo","Copper-catalyzed regioselective cyclization of vinyl azides by gem-difluoromethylene for trisubstituted pyridines","Organic Chemistry Frontiers","2019","6","4","468","","10.1039/C8QO01212A","","x-ray","1.54178","CuKα","","0.048","0.0415","","","0.1039","0.1129","","","","","","1.042","","","","has coordinates","237318","2020-10-21","18:00:00",""
"1554537","5.2572","0.001","12.458","0.003","13.205","0.003","69.94","0.03","83.57","0.03","89.74","0.03","806.7","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H17 Br N4 O -","- C17 H17 Br N4 O -","- C34 H34 Br2 N8 O2 -","2","1","","Lemport, Pavel S.; Smolyar, Ivan V.; Khrustalev, Victor N.; Roznyatovsky, Vitaly A.; Popov, Alexander V.; Kobelevskaya, Valentina A.; Rozentsveig, Igor B.; Nenajdenko, Valentine G.","3,3-Diazidoenones ‒ new types of highly reactive bis-azides. Preparation and synthetic transformations","Organic Chemistry Frontiers","2019","6","3","335","","10.1039/C8QO01214H","","","0.9626","synchrotron","","0.0871","0.0615","","","0.1321","0.1567","","","","","","1.057","","","","has coordinates","237320","2020-10-21","18:00:00",""
"1554538","12.429","0.003","10.415","0.002","37.841","0.008","90","","90.13","0.03","90","","4898.4","1.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H21 N2 O P -","- C27 H21 N2 O P -","- C216 H168 N16 O8 P8 -","8","2","","Lemport, Pavel S.; Smolyar, Ivan V.; Khrustalev, Victor N.; Roznyatovsky, Vitaly A.; Popov, Alexander V.; Kobelevskaya, Valentina A.; Rozentsveig, Igor B.; Nenajdenko, Valentine G.","3,3-Diazidoenones ‒ new types of highly reactive bis-azides. Preparation and synthetic transformations","Organic Chemistry Frontiers","2019","6","3","335","","10.1039/C8QO01214H","","","0.9626","synchrotron","","0.0717","0.0524","","","0.1369","0.1567","","","","","","1.057","","","","has coordinates","237320","2020-10-21","18:00:00",""
"1554539","8.8134","0.0002","10.3559","0.0003","18.035","0.0004","100.993","0.002","95.022","0.002","92.933","0.002","1605.78","0.07","293","2","293","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H44 N2 O Si -","- C34 H44 N2 O Si -","- C68 H88 N4 O2 Si2 -","2","1","","Chen, Cui-Hong; Chai, Yun; Zhou, Zheng-Xin; Rao, Wei-Hao; Liu, Bin; Liu, Li; Xu, Ran; Liu, Yue-Jin; Zeng, Ming-Hua","Room-temperature Pd(ii)-catalyzed direct C‒H TIPS-ethynylation of phenylacetic amides with terminal alkynes","Organic Chemistry Frontiers","2019","6","4","442","","10.1039/C8QO01215F","","x-ray","1.54184","CuKα","","0.0943","0.0837","","","0.2634","0.2881","","","","","","1.199","","","","has coordinates","237322","2020-10-21","18:00:00",""
"1554540","44.902","0.003","11.1591","0.001","10.6337","0.0007","90","","90","","90","","5328.2","0.7","293","2","293.15","","","","","","","","","2","P m n 21","P 2ac -2","31","","","","- C35 H30 -","- C35 H30 -","- C280 H240 -","8","2","","Liu, Peiren; Li, Qi; Zeng, Hong; Shi, Bingbing; Liu, Jiyong; Huang, Feihe","[15]Paracyclophane and [16]paracyclophane: facile syntheses, crystal structures and selective complexation with cesium cations in the gas phase","Organic Chemistry Frontiers","2019","6","3","309","","10.1039/C8QO01218K","","","0.71073","MoKα","","0.1151","0.0659","","","0.1395","0.1705","","","","","","1.034","","","","has coordinates","237323","2020-10-21","18:00:00",""
"1554541","11.372","0.0004","13.1796","0.0006","24.509","0.001","105.144","0.004","93.375","0.003","90.36","0.003","3538.8","0.3","296","2","296.15","","","","","","","","","2","P -1","-P 1","2","","","","- C42 H36 -","- C42 H36 -","- C168 H144 -","4","2","","Liu, Peiren; Li, Qi; Zeng, Hong; Shi, Bingbing; Liu, Jiyong; Huang, Feihe","[15]Paracyclophane and [16]paracyclophane: facile syntheses, crystal structures and selective complexation with cesium cations in the gas phase","Organic Chemistry Frontiers","2019","6","3","309","","10.1039/C8QO01218K","","","0.71073","MoKα","","0.1065","0.0559","","","0.1406","0.1715","","","","","","1.019","","","","has coordinates","237323","2020-10-21","18:00:00",""
"1554542","14.2625","0.0006","18.0213","0.0012","31.3062","0.0019","86.466","0.005","83.674","0.005","83.298","0.005","7933.2","0.8","173","1","173","1","","","","","","","","5","P -1","-P 1","2","2S1Se","2S1Se","","- C42 H54 O6 S2 Se -","- C42 H54 O6 S2.0001 Se0.9999 -","- C336 H432 O48 S16.0008 Se7.9992 -","8","4","","Wang, Shitao; Shang, Jihai; Yan, Chaoxian; Wang, Wenbo; Yuan, Chengshan; Zhang, Hao-Li; Shao, Xiangfeng","Trichalcogenasumanenes containing various chalcogen atoms: synthesis, structure, properties, and chemical reactivity","Organic Chemistry Frontiers","2019","6","2","263","","10.1039/C8QO01220B","","","0.71073","MoKα","","0.3577","0.1279","","","0.2179","0.3316","","","","","","0.978","","","","has coordinates,has disorder","237326","2020-10-21","18:00:00",""
"1554543","17.4194","0.0002","8.2052","0.0001","28.3968","0.0004","90","","90.166","0.001","90","","4058.73","0.09","290","1","290","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2S1Se_Ester","2S1Se_Ester","","- C42 H54 O8 S2 Se -","- C42 H53.2 O8 S2 Se -","- C168 H212.8 O32 S8 Se4 -","4","1","","Wang, Shitao; Shang, Jihai; Yan, Chaoxian; Wang, Wenbo; Yuan, Chengshan; Zhang, Hao-Li; Shao, Xiangfeng","Trichalcogenasumanenes containing various chalcogen atoms: synthesis, structure, properties, and chemical reactivity","Organic Chemistry Frontiers","2019","6","2","263","","10.1039/C8QO01220B","","","1.54184","CuKα","","0.1591","0.1451","","","0.4154","0.4404","","","","","","1.954","","","","has coordinates,has disorder","237326","2020-10-21","18:00:00",""
"1554544","12.1441","0.0008","16.8305","0.0009","20.8669","0.0013","98.844","0.005","91.448","0.005","102.981","0.005","4098.7","0.4","174","2","174","2","","","","","","","","5","P -1","-P 1","2","2Te1se","2Te1Se","","- C42 H54 O6 Se Te2 -","- C42 H54 O6 Se0.9999 Te2.0001 -","- C168 H216 O24 Se3.9996 Te8.0004 -","4","2","","Wang, Shitao; Shang, Jihai; Yan, Chaoxian; Wang, Wenbo; Yuan, Chengshan; Zhang, Hao-Li; Shao, Xiangfeng","Trichalcogenasumanenes containing various chalcogen atoms: synthesis, structure, properties, and chemical reactivity","Organic Chemistry Frontiers","2019","6","2","263","","10.1039/C8QO01220B","","","0.71073","MoKα","","0.222","0.1224","","","0.2831","0.3567","","","","","","1.05","","","","has coordinates,has disorder","237326","2020-10-21","18:00:00",""
"1554545","14.2879","0.0004","18.0394","0.0007","31.4094","0.0008","86.414","0.002","83.365","0.002","83.373","0.002","7977.7","0.4","174","2","174","2","","","","","","","","5","P -1","-P 1","2","2Se1S","2Se1S","","- C42 H54 O6 S Se2 -","- C42 H54 O6 S0.9999 Se2.0001 -","- C336 H432 O48 S7.9992 Se16.0008 -","8","4","","Wang, Shitao; Shang, Jihai; Yan, Chaoxian; Wang, Wenbo; Yuan, Chengshan; Zhang, Hao-Li; Shao, Xiangfeng","Trichalcogenasumanenes containing various chalcogen atoms: synthesis, structure, properties, and chemical reactivity","Organic Chemistry Frontiers","2019","6","2","263","","10.1039/C8QO01220B","","","0.71073","MoKα","","0.147","0.0737","","","0.1493","0.1919","","","","","","1.024","","","","has coordinates,has disorder","237326","2020-10-21","18:00:00",""
"1554546","13.0718","0.0011","15.5471","0.0013","10.5005","0.0009","90","","113.181","0.001","90","","1961.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 Br N2 O -","- C24 H19 Br N2 O -","- C96 H76 Br4 N8 O4 -","4","1","","Liu, Xiong-Li; Yue, Jing; Chen, Shuang; Liu, Huan-Huan; Yang, Kai-Mo; Feng, Ting-Ting; Zhou, Ying","Thermal-mediated catalyst-free heterolytic cleavage of 3-halooxindoles: rapid access to 3-functionalized-2-oxindoles","Organic Chemistry Frontiers","2019","6","2","256","","10.1039/C8QO01222A","","","0.71073","MoKα","","0.0703","0.043","","","0.0855","0.0951","","","","","","1.005","","","","has coordinates","237329","2020-10-21","18:00:00",""
"1554547","12.9966","0.0015","15.5319","0.0017","10.522","0.0012","90","","113.397","0.002","90","","1949.3","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 Cl N2 O -","- C24 H19 Cl N2 O -","- C96 H76 Cl4 N8 O4 -","4","1","","Liu, Xiong-Li; Yue, Jing; Chen, Shuang; Liu, Huan-Huan; Yang, Kai-Mo; Feng, Ting-Ting; Zhou, Ying","Thermal-mediated catalyst-free heterolytic cleavage of 3-halooxindoles: rapid access to 3-functionalized-2-oxindoles","Organic Chemistry Frontiers","2019","6","2","256","","10.1039/C8QO01222A","","","0.71073","MoKα","","0.1316","0.0594","","","0.1392","0.1615","","","","","","0.835","","","","has coordinates","237329","2020-10-21","18:00:00",""
"1554548","9.5976","0.0009","10.3316","0.0009","13.9249","0.0013","90","","90","","90","","1380.8","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H14 Cl N O2 -","- C16 H14 Cl N O2 -","- C64 H56 Cl4 N4 O8 -","4","1","","Liu, Xiong-Li; Yue, Jing; Chen, Shuang; Liu, Huan-Huan; Yang, Kai-Mo; Feng, Ting-Ting; Zhou, Ying","Thermal-mediated catalyst-free heterolytic cleavage of 3-halooxindoles: rapid access to 3-functionalized-2-oxindoles","Organic Chemistry Frontiers","2019","6","2","256","","10.1039/C8QO01222A","","","0.71073","MoKα","","0.0261","0.0251","","","0.0706","0.0713","","","","","","1.064","","","","has coordinates","237329","2020-10-21","18:00:00",""
"1554549","8.802","0.0005","9.9463","0.0007","10.213","0.0008","116.522","0.007","100.853","0.006","103.243","0.005","734.13","0.11","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C19 H16 N2 O -","- C19 H16 N2 O -","- C38 H32 N4 O2 -","2","1","","Liu, Xiong-Li; Yue, Jing; Chen, Shuang; Liu, Huan-Huan; Yang, Kai-Mo; Feng, Ting-Ting; Zhou, Ying","Thermal-mediated catalyst-free heterolytic cleavage of 3-halooxindoles: rapid access to 3-functionalized-2-oxindoles","Organic Chemistry Frontiers","2019","6","2","256","","10.1039/C8QO01222A","","x-ray","0.71073","MoKα","","0.0591","0.048","","","0.1137","0.123","","","","","","1.04","","","","has coordinates","237329","2020-10-21","18:00:00",""
"1554550","33.58","0.005","13.96","0.002","8.0737","0.0013","90","","100.506","0.003","90","","3721.3","1","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H19 Cl2 N O4 -","- C19 H19 Cl2 N O4 -","- C152 H152 Cl16 N8 O32 -","8","1","","Liu, Xiong-Li; Yue, Jing; Chen, Shuang; Liu, Huan-Huan; Yang, Kai-Mo; Feng, Ting-Ting; Zhou, Ying","Thermal-mediated catalyst-free heterolytic cleavage of 3-halooxindoles: rapid access to 3-functionalized-2-oxindoles","Organic Chemistry Frontiers","2019","6","2","256","","10.1039/C8QO01222A","","","0.71073","MoKα","","0.1178","0.0945","","","0.257","0.2749","","","","","","1.047","","","","has coordinates","237329","2020-10-21","18:00:00",""
"1554551","11.8513","0.0006","8.0917","0.0004","24.6768","0.0012","90","","90","","90","","2366.4","0.2","295.38","0.1","295.38","0.1","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C13 H22 O2 -","- C13 H22 O2 -","- C104 H176 O16 -","8","1","","He, Min; Yi, Jiuzhou; Zhao, Gaoyuan; Chen, Peiqi; Long, Dan; Hu, Xiaojun; Li, Huilin; Xie, Xingang; Wang, Xiaolei; She, Xuegong","A concise approach to the tricyclic framework of longipinane- and ent-longipinane-type sesquiterpenoids","Organic Chemistry Frontiers","2019","6","3","383","","10.1039/C8QO01235K","","","0.71073","MoKα","","0.0908","0.0642","","","0.152","0.1749","","","","","","1.066","","","","has coordinates","237331","2020-10-21","18:00:00",""
"1554552","9.1789","0.0003","10.574","0.0003","11.4116","0.0004","90","","91.684","0.003","90","","1107.11","0.06","292","2","292","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H24 O5 S -","- C25 H24 O5 S -","- C50 H48 O10 S2 -","2","1","","Zhang, Nan; He, Tingting; Liu, Yidong; Li, Shan; Tan, Yu; Peng, Lei; Li, Dongmei; Shan, Chunhui; Yan, Hailong","Organocatalytic atropo- and E/Z-selective Michael addition reaction of ynones with α-amido sulfones as sulfone-type nucleophile","Organic Chemistry Frontiers","2019","6","4","451","","10.1039/C8QO01241E","","","0.71073","MoKα","","0.0639","0.0464","","","0.0909","0.1016","","","","","","1.046","","","","has coordinates","237333","2020-10-21","18:00:00",""
"1554553","9.809","0.008","9.877","0.008","9.925","0.008","66.084","0.014","65.463","0.014","64.347","0.015","758.1","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H10 F3 N O6 Se -","- C12 H10 F3 N O6 Se -","- C24 H20 F6 N2 O12 Se2 -","2","1","","Ge, Hangming; Shen, Qilong","Trifluoromethyl-substituted selenium ylide: a broadly applicable electrophilic trifluoromethylating reagent","Organic Chemistry Frontiers","2019","6","13","2205","","10.1039/C8QO01249K","","","0.71073","MoKα","","0.0583","0.0435","","","0.093","0.0982","","","","","","1.001","","","","has coordinates","237335","2020-10-21","18:00:00",""
"1554554","10.5315","0.0008","7.0899","0.0004","12.4878","0.0012","90","","105.29","0.008","90","","899.43","0.13","113","2","113","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H29 N O S -","- C20 H29 N O S -","- C40 H58 N2 O2 S2 -","2","1","","Qin, Shuanglin; Liu, Tongtong; Luo, Yunhao; Jiang, Shende; Yang, Guang","Diastereoselective Rh-catalyzed decarboxylative allylation to form quaternary stereocenters using sulfinimine as the directing group","Organic Chemistry Frontiers","2019","6","6","732","","10.1039/C8QO01258J","","","0.71073","MoKα","","0.0454","0.0372","","","0.0829","0.0865","","","","","","1.027","","","","has coordinates","237336","2020-10-21","18:00:00",""
"1554555","41.982","0.002","8.4505","0.0002","16.3226","0.0009","90","","123.085","0.008","90","","4851.8","0.6","100","0.1","100","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H31 N3 Si -","- C26 H31 N3 Si -","- C208 H248 N24 Si8 -","8","1","","Wu, Wanqing; Fang, Songjia; Jiang, Guangbin; Li, Meng; Jiang, Huanfeng","Palladium-catalyzed regioselective C‒H alkynylation of indoles with bromoalkynes in water","Organic Chemistry Frontiers","2019","6","13","2200","","10.1039/C8QO01261J","","x-ray","0.71073","MoKα","","0.104","0.0955","","","0.2461","0.2565","","","","","","1.028","","","","has coordinates","237338","2020-10-21","18:00:00",""
"1554556","5.7768","0.0005","26.401","0.002","15.2336","0.0014","90","","95.248","0.002","90","","2313.6","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H25 N O2 -","- C30 H25 N O2 -","- C120 H100 N4 O8 -","4","1","","Ji, Cheng-Long; Pan, Yao; Geng, Fang-Zhou; Hao, Wen-Juan; Tu, Shu-Jiang; Jiang, Bo","Synergistic silver/scandium catalytic spiroketalization of β-alkynyl ketones for the atom economical synthesis of skeletally diverse spirocyclic isochromenes","Organic Chemistry Frontiers","2019","6","4","474","","10.1039/C8QO01277F","","","0.71073","MoKα","","0.1742","0.0652","","","0.069","0.0817","","","","","","1.006","","","","has coordinates","237339","2020-10-21","18:00:00",""
"1554557","31.1655","0.0005","8.4946","0.0001","13.3472","0.0002","90","","98.752","0.002","90","","3492.37","0.09","100","0.1","100","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H21 N O2 S -","- C21 H21 N O2 S -","- C168 H168 N8 O16 S8 -","8","1","","Wu, Feng; Chen, Lianfen; Wang, Yongdong; Zhu, Shifa","Gold-catalyzed generation of azafulvenium from an enyne sulfonamide: rapid access to fully substituted pyrroles","Organic Chemistry Frontiers","2019","6","4","480","","10.1039/C8QO01278D","","x-ray","1.54184","CuKα","","0.0434","0.0423","","","0.1101","0.1111","","","","","","1.082","","","","has coordinates","237340","2020-10-21","18:00:00",""
"1554558","8.6549","0.0005","18.21","0.0011","11.9124","0.0006","90","","94.769","0.005","90","","1870.96","0.18","172.95","0.1","172.95","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H18 Br N O3 S -","- C21 H18 Br N O3 S -","- C84 H72 Br4 N4 O12 S4 -","4","1","","Wu, Feng; Chen, Lianfen; Wang, Yongdong; Zhu, Shifa","Gold-catalyzed generation of azafulvenium from an enyne sulfonamide: rapid access to fully substituted pyrroles","Organic Chemistry Frontiers","2019","6","4","480","","10.1039/C8QO01278D","","x-ray","1.54184","CuKα","","0.0832","0.0759","","","0.2101","0.2302","","","","","","1.017","","","","has coordinates","237340","2020-10-21","18:00:00",""
"1554559","9.7904","0.0003","10.7882","0.0004","12.3517","0.0004","83.891","0.001","69.723","0.001","84.499","0.001","1214.36","0.07","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H36 N2 O2 Si -","- C28 H36 N2 O2 Si -","- C56 H72 N4 O4 Si2 -","2","1","","Kong, De-Shen; Wang, Yi-Fan; Tan, Yun-Xuan; Zhang, Jun-Li; Zhang, Jian-Ge; Tian, Ping; Lin, Guo-Qiang","Trisannulation of benzamides and cyclohexadienone-tethered 1,1-disubstituted allenes initiated by Cp*Rh(iii)-catalyzed C‒H activation","Organic Chemistry Frontiers","2019","6","5","699","","10.1039/C8QO01279B","","","1.54178","cukα","","0.037","0.0364","","","0.0926","0.093","","","","","","1.037","","","","has coordinates","237342","2020-10-21","18:00:00",""
"1554560","9.9601","0.0004","10.6766","0.0003","11.8691","0.0004","74.393","0.001","85.571","0.001","88.958","0.001","1211.99","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H31 N O4 Si -","- C27 H31 N O4 Si -","- C54 H62 N2 O8 Si2 -","2","1","","Kong, De-Shen; Wang, Yi-Fan; Tan, Yun-Xuan; Zhang, Jun-Li; Zhang, Jian-Ge; Tian, Ping; Lin, Guo-Qiang","Trisannulation of benzamides and cyclohexadienone-tethered 1,1-disubstituted allenes initiated by Cp*Rh(iii)-catalyzed C‒H activation","Organic Chemistry Frontiers","2019","6","5","699","","10.1039/C8QO01279B","","","0.71073","MoKα","","0.0708","0.0582","","","0.1647","0.1781","","","","","","1.031","","","","has coordinates","237342","2020-10-21","18:00:00",""
"1554561","8.24","0.0004","10.3859","0.0004","17.7438","0.0008","90","","95.373","0.004","90","","1511.84","0.12","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H26 Cl2 N4 O4 S2 -","- C31 H24 Cl2 N4 O4 S2 -","- C62 H48 Cl4 N8 O8 S4 -","2","0.5","","Han, Shuaijun; Gao, Xianying; Wu, Qingsong; Li, Jingya; Zou, Dapeng; Wu, Yusheng; Wu, Yangjie","Nickel-promoted C(2)‒H amidation of quinoline N-oxides with N-fluorobenzenesulfonimide","Organic Chemistry Frontiers","2019","6","6","830","","10.1039/C8QO01281D","","x-ray","1.54184","CuKα","","0.0771","0.0642","","","0.1813","0.1981","","","","","","1.049","","","","has coordinates","237344","2020-10-21","18:00:00",""
"1554562","25.795","0.004","9.144","0.0015","21.256","0.004","90","","90","","90","","5013.6","1.5","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C25.5 H28 Cl N4 O2.5 Pd -","- C25.5 H25 Cl N4 O2.5 Pd -","- C204 H200 Cl8 N32 O20 Pd8 -","8","2","","Sun, Wen-Wu; Liu, Ji-Kai; Wu, Bin","Practical synthesis of polysubstituted unsymmetric 1,10-phenanthrolines by palladium catalyzed intramolecular oxidative cross coupling of C(sp2)–H and C(sp3)–H bonds of carboxamides","Organic Chemistry Frontiers","2019","6","4","544","","10.1039/C8QO01290C","","","0.71073","MoKα","","0.0827","0.072","","","0.2088","0.2181","","","","","","1.088","","","","has coordinates","274176","2022-03-31","10:10:26",""
"1554563","26.203","0.004","10.644","0.0015","30.852","0.004","90","","106.633","0.002","90","","8245","2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H11 Br N2 -","- C18 H11 Br N2 -","- C432 H264 Br24 N48 -","24","3","","Sun, Wen-Wu; Liu, Ji-Kai; Wu, Bin","Practical synthesis of polysubstituted unsymmetric 1,10-phenanthrolines by palladium catalyzed intramolecular oxidative cross coupling of C(sp2)‒H and C(sp3)‒H bonds of carboxamides","Organic Chemistry Frontiers","2019","6","4","544","","10.1039/C8QO01290C","","","0.71073","MoKα","","0.0794","0.0469","","","0.098","0.1102","","","","","","1.022","","","","has coordinates","237346","2020-10-21","18:00:00",""
"1554564","5.712","0.004","15.28","0.013","8.28","0.005","90","","104.192","0.015","90","","700.6","0.9","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H18 O2 S -","- C16 H18 O2 S -","- C32 H36 O4 S2 -","2","1","","Sun, Yongjie; Jiang, Jun; Guo, Xiaochong; Wen, Jialin; Zhang, Xumu","Asymmetric hydrogenation of α,β-unsaturated sulfones by a rhodium/thiourea‒bisphosphine complex","Organic Chemistry Frontiers","2019","6","9","1438","","10.1039/C8QO01291A","","x-ray","0.71073","MoKα","","0.0256","0.0246","","","0.0619","0.0623","","","","","","1.043","","","","has coordinates","237348","2020-10-21","18:00:00",""
"1554565","13.6813","0.0019","13.6813","0.0019","29.053","0.006","90","","90","","90","","5438.1","1.5","173","2","173.15","","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C32 H27 N O4 S -","- C32 H27 N O4 S -","- C256 H216 N8 O32 S8 -","8","1","","Chen, Kun-Quan; Gao, Zhong-Hua; Ye, Song","Bifunctional N-heterocyclic carbene catalyzed [3 + 4] annulation of enals with azadienes: enantioselective synthesis of benzofuroazepinones","Organic Chemistry Frontiers","2019","6","3","405","","10.1039/C8QO01302K","","","0.71073","MoKα","","0.0573","0.0562","","","0.1116","0.1119","","","","","","1.238","","","","has coordinates","237350","2020-10-21","18:00:00",""
"1554566","11.043","0.003","14.753","0.005","17.258","0.005","90","","90","","90","","2811.6","1.5","173","2","173.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H29 N O4 S -","- C33 H29 N O4 S -","- C132 H116 N4 O16 S4 -","4","1","","Chen, Kun-Quan; Gao, Zhong-Hua; Ye, Song","Bifunctional N-heterocyclic carbene catalyzed [3 + 4] annulation of enals with azadienes: enantioselective synthesis of benzofuroazepinones","Organic Chemistry Frontiers","2019","6","3","405","","10.1039/C8QO01302K","","","0.71073","MoKα","","0.0804","0.0755","","","0.1196","0.1217","","","","","","1.27","","","","has coordinates","237350","2020-10-21","18:00:00",""
"1554567","9.1375","0.0001","13.1527","0.0002","16.354","0.0003","95.187","0.001","95.294","0.001","103.04","0.001","1894.04","0.05","100","0.18","100","0.18","","","","","","","","3","P -1","-P 1","2","","","","- C22 H24 O7 -","- C22 H24 O7 -","- C88 H96 O28 -","4","2","","Liu, Hongxin; Tan, Haibo; Wang, Wenxuan; Zhang, Wenge; Chen, Yuchan; Li, Saini; Liu, Zhaoming; Li, Haohua; Zhang, Weimin","Cytorhizophins A and B, benzophenone-hemiterpene adducts from the endophytic fungus Cytospora rhizophorae","Organic Chemistry Frontiers","2019","6","5","591","","10.1039/C8QO01306C","","x-ray","1.54184","CuKα","","0.0398","0.0375","","","0.0984","0.1009","","","","","","1.049","","","","has coordinates","237352","2020-10-21","18:00:00",""
"1554568","13.8718","0.0006","9.6965","0.0005","13.8978","0.0007","90","","92.204","0.004","90","","1867.98","0.16","99.9","0.3","99.9","0.3","","","","","","","","4","P 1 2 1","P 2y","3","","","","- C18 H17 Cl3 O5 -","- C18 H17 Cl3 O5 -","- C72 H68 Cl12 O20 -","4","2","","Liu, Hongxin; Tan, Haibo; Wang, Wenxuan; Zhang, Wenge; Chen, Yuchan; Li, Saini; Liu, Zhaoming; Li, Haohua; Zhang, Weimin","Cytorhizophins A and B, benzophenone-hemiterpene adducts from the endophytic fungus Cytospora rhizophorae","Organic Chemistry Frontiers","2019","6","5","591","","10.1039/C8QO01306C","","x-ray","1.54184","CuKα","","0.0925","0.0821","","","0.2023","0.2154","","","","","","1.063","","","","has coordinates","237352","2020-10-21","18:00:00",""
"1554569","21.469","0.004","29.096","0.006","28.543","0.006","90","","95.17","0.03","90","","17757","6","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C172 H203 N13 O10 P2 -","- C172 H203 N13 O10 P2 -","- C688 H812 N52 O40 P8 -","4","0.5","","Lee, Chaeeun; Lee, Hyemi; Lee, Seungwon; Jeon, Hae-Geun; Jeong, Kyu-Sung","Encapsulation of dihydrogenphosphate ions as a cyclic dimer to the cavities of site-specifically modified indolocarbazole-pyridine foldamers","Organic Chemistry Frontiers","2019","6","3","299","","10.1039/C8QO01307A","","","0.7","synchrotron","","0.1761","0.0712","","","0.1519","0.1857","","","","","","0.828","","","","has coordinates,has disorder","237355","2020-10-21","18:00:00",""
"1554570","21.505","0.004","29.114","0.006","28.751","0.006","90","","94.83","0.03","90","","17937","6","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Inverted_pyridine_heptamer","","- C173 H203 N13 O10 P2 -","- C173 H203 N13 O10 P2 -","- C692 H812 N52 O40 P8 -","4","0.5","","Lee, Chaeeun; Lee, Hyemi; Lee, Seungwon; Jeon, Hae-Geun; Jeong, Kyu-Sung","Encapsulation of dihydrogenphosphate ions as a cyclic dimer to the cavities of site-specifically modified indolocarbazole-pyridine foldamers","Organic Chemistry Frontiers","2019","6","3","299","","10.1039/C8QO01307A","","","0.7","synchrotron","","0.1314","0.0904","","","0.2576","0.2822","","","","","","1.017","","","","has coordinates,has disorder","237355","2020-10-21","18:00:00",""
"1554571","8.968","0.0015","9.084","0.0016","14.804","0.002","90","","105.357","0.004","90","","1163","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 N2 O2 S -","- C12 H12 N2 O2 S -","- C48 H48 N8 O8 S4 -","4","1","","Zu, Weisai; Liu, Shuai; Jia, Xin; Xu, Liang","Chemoselective N-arylation of aminobenzene sulfonamides via copper catalysed Chan‒Evans‒Lam reactions","Organic Chemistry Frontiers","2019","6","9","1356","","10.1039/C8QO01313F","","","0.71073","MoKα","","0.0587","0.0416","","","0.0921","0.1012","","","","","","1.026","","","","has coordinates","237357","2020-10-21","18:00:00",""
"1554572","8.0275","0.0015","8.0254","0.0017","12.699","0.003","90","","101.787","0.007","90","","800.9","0.3","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H15 N O2 S -","- C19 H15 N O2 S -","- C38 H30 N2 O4 S2 -","2","1","","Zhao, Zi-Biao; Shi, Lei; Meng, Fan-Jie; Li, Yaming; Zhou, Yong-Gui","Synthesis of chiral seven-membered cyclic sulfonamides through palladium-catalyzed arylation of cyclic imines","Organic Chemistry Frontiers","2019","6","10","1572","","10.1039/C8QO01323C","","","0.71073","MoKα","","0.0292","0.0285","","","0.0777","0.0784","","","","","","1.056","","","","has coordinates","237358","2020-10-21","18:00:00",""
"1554573","6.9308","0.0008","6.9507","0.0008","11.8464","0.0014","84.194","0.006","79.023","0.006","64.094","0.006","503.84","0.11","293","2","293","2","","","","","","","","4","P 1","P 1","1","","","","- C10 H13 N O3 -","- C10 H13 N O3 -","- C20 H26 N2 O6 -","2","2","","Yang, Wu-Lin; Sun, Zhong-Tao; Zhang, Jian; Li, Zhong; Deng, Wei-Ping","Enantioselective synthesis of 3-amino-hydrobenzofuran-2,5-diones via Cu(i)-catalyzed intramolecular conjugate addition of imino esters","Organic Chemistry Frontiers","2019","6","5","579","","10.1039/C8QO01335G","","","1.54178","CuKα","","0.0598","0.0514","","","0.1367","0.1453","","","","","","1.068","","","","has coordinates","237360","2020-10-21","18:00:00",""
"1554574","15.1538","0.0003","13.5668","0.0003","27.2737","0.0005","90","","92.794","0.002","90","","5600.5","0.2","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","Mikki_PCM2_09_04_17","","","- C116 H162 Br F3 O12 -","- C116 H162 Br F3 O12 -","- C232 H324 Br2 F6 O24 -","2","1","","Al-Azemi, Talal F.; Vinodh, Mickey; Alipour, Fatemeh H.; Mohamod, Abdirahman A.","Chiral discrimination of 2-heptlyaminium salt by planar-chiral monohydroxy-functionalized pillar[5]arenes","Organic Chemistry Frontiers","2019","6","5","603","","10.1039/C8QO01343H","","","1.54178","CuKα","","0.1467","0.1071","","","0.2924","0.3259","","","","","","1.079","","","","has coordinates","237362","2020-10-21","18:00:00",""
"1554575","15.0627","0.0008","13.3599","0.0007","27.1554","0.0019","90","","94.396","0.007","90","","5448.6","0.6","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C116 H162 Br F3 O12 -","- C116 H162 Br F3 O12 -","- C232 H324 Br2 F6 O24 -","2","1","","Al-Azemi, Talal F.; Vinodh, Mickey; Alipour, Fatemeh H.; Mohamod, Abdirahman A.","Chiral discrimination of 2-heptlyaminium salt by planar-chiral monohydroxy-functionalized pillar[5]arenes","Organic Chemistry Frontiers","2019","6","5","603","","10.1039/C8QO01343H","","","0.71075","MoKα","","0.1679","0.1101","","","0.2937","0.338","","","","","","1.112","","","","has coordinates","237362","2020-10-21","18:00:00",""
"1554576","7.15","0.005","11.643","0.007","12.098","0.008","90","","95.268","0.013","90","","1002.9","1.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 N2 Se -","- C10 H8 N2 Se -","- C40 H32 N8 Se4 -","4","1","","Cao, Yuan; Liu, Jie; Liu, Fanmin; Jiang, Lvqi; Yi, Wenbin","Copper-catalyzed direct and odorless selenylation with a sodium selenite-based reagent","Organic Chemistry Frontiers","2019","6","6","825","","10.1039/C8QO01355A","","","0.71073","MoKα","","0.0668","0.0388","","","0.0928","0.1044","","","","","","1.051","","","","has coordinates","237364","2020-10-21","18:00:00",""
"1554577","5.799","0.003","7.486","0.004","10.479","0.006","90","","104.17","0.04","90","","441.1","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C9 H9 F3 N2 -","- C9 H9 F3 N2 -","- C18 H18 F6 N4 -","2","1","","Chen, Mu-Wang; Deng, Zhihong; Yang, Qin; Huang, Jian; Peng, Yiyuan","Enantioselective synthesis of trifluoromethylated dihydroquinoxalinones via palladium-catalyzed hydrogenation","Organic Chemistry Frontiers","2019","6","6","746","","10.1039/C8QO01361F","","","1.54178","CuKα","","0.2357","0.0964","","","0.2635","0.3757","","","","","","1.398","","","","has coordinates","237366","2020-10-21","18:00:00",""
"1554578","9.1297","0.0008","10.326","0.0009","24.127","0.0018","90","","90","","90","","2274.5","0.3","123.2","0.2","123.2","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H24 N2 O2 -","- C29 H24 N2 O2 -","- C116 H96 N8 O8 -","4","1","","Xu, Lubin; Chen, Haohua; Liu, Jian; Zhou, Lan; Liu, Qing; Lan, Yu; Xiao, Jian","Chiral phosphoric acid-catalyzed asymmetric C(sp3)‒H functionalization of biomass-derived 2,5-dimethylfuran via two sequential Cope-type rearrangements","Organic Chemistry Frontiers","2019","6","8","1162","","10.1039/C8QO01375F","","","1.54184","CuKα","","0.0767","0.0574","","","0.1248","0.1388","","","","","","1.04","","","","has coordinates","237368","2020-10-21","18:00:00",""
"1554579","32.1461","0.0004","11.483","0.0001","8.0162","0.0001","90","","90","","90","","2959.05","0.06","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C9.23 H13.23 O3.69 -","- C9.53846 H12.9231 O3.38462 -","- C124 H168 O44 -","13","3.25","","Zhang, Jia; He, Jun; Cheng, Yung-Chi; Zhang, Pei-Cheng; Yan, Yu; Zhang, Hao-Jun; Zhang, Wei-Ku; Xu, Jie-Kun","Fischernolides A‒D, four novel diterpene-based meroterpenoid scaffolds with antitumor activities from Euphorbia fischeriana","Organic Chemistry Frontiers","2019","6","14","2312","","10.1039/C8QO01379A","","","1.54184","CuKα","","0.0384","0.0379","","","0.1","0.1004","","","","","","1.1","","","","has coordinates","237370","2020-10-21","18:00:00",""
"1554580","11.351","0.002","11.9996","0.0017","21.215","0.003","90","","90","","90","","2889.6","0.8","296","2","296.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C35 H26 Cl N5 O -","- C35 H26 Cl N5 O -","- C140 H104 Cl4 N20 O4 -","4","1","","Sun, Bing-Bing; Zhang, Jun-Qi; Chen, Jun-Bo; Fan, Wei-Tai; Yu, Jie-Qiang; Hu, Jia-Ming; Wang, Xing-Wang","Stereoselective synthesis of spirocyclohexadiene-pyrazolones via organic base and/or hydrogen bonding assisted [3 + 3] annulation reactions","Organic Chemistry Frontiers","2019","6","11","1842","","10.1039/C8QO01391H","","","0.71073","MoKα","","0.0864","0.064","","","0.1786","0.192","","","","","","1.078","","","","has coordinates","237372","2020-10-21","18:00:00",""
"1554581","9.3289","0.0004","10.9229","0.0005","12.8668","0.0006","87.237","0.001","78.614","0.001","85.681","0.001","1280.91","0.1","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H23 Cl N4 O -","- C33 H23 Cl N4 O -","- C66 H46 Cl2 N8 O2 -","2","1","","Sun, Bing-Bing; Zhang, Jun-Qi; Chen, Jun-Bo; Fan, Wei-Tai; Yu, Jie-Qiang; Hu, Jia-Ming; Wang, Xing-Wang","Stereoselective synthesis of spirocyclohexadiene-pyrazolones via organic base and/or hydrogen bonding assisted [3 + 3] annulation reactions","Organic Chemistry Frontiers","2019","6","11","1842","","10.1039/C8QO01391H","","","0.71073","MoKα","","0.0479","0.0369","","","0.1022","0.1242","","","","","","1.148","","","","has coordinates","237372","2020-10-21","18:00:00",""
"1554582","7.9193","0.0001","15.3744","0.0002","16.4929","0.0002","90","","90","","90","","2008.08","0.04","291","2","291","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H14 F3 N O4 S -","- C16 H14 F3 N O4 S -","- C64 H56 F12 N4 O16 S4 -","4","1","","Gui, Yang; Liang, Xinping; Li, Yanan; Li, Kuiliang; Zha, Zhenggen; Wang, Zhiyong","Asymmetric synthesis of fluoroalkylated N,O-ketals via an organocatalytic dehydration/aminalization/aza-Michael desymmetrization","Organic Chemistry Frontiers","2019","6","7","942","","10.1039/C8QO01397G","","","1.54184","CuKα","","0.0407","0.0401","","","0.1113","0.1125","","","","","","1.046","","","","has coordinates","237374","2020-10-21","18:00:00",""
"1554583","28.168","0.003","11.3424","0.0013","10.2126","0.0012","90","","90","","90","","3262.9","0.6","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H32 Br N O4 P2 -","- C36 H32 Br N O4 P2 -","- C144 H128 Br4 N4 O16 P8 -","4","1","","Liu, Bing; Li, Wenbo; Wu, Hai-Hong; Zhang, Junliang","Enantiodivergent synthesis of 1,2-bis(diphenylphosphino)ethanes via asymmetric [3 + 2]-cycloaddition","Organic Chemistry Frontiers","2019","6","5","694","","10.1039/C8QO01404C","","","0.71073","MoKα","","0.0996","0.0581","","","0.1202","0.1385","","","","","","1.011","","","","has coordinates","237376","2020-10-21","18:00:00",""
"1554584","9.2282","0.0014","9.1743","0.0014","12.829","0.002","90","","109.724","0.003","90","","1022.4","0.3","120.15","","120.15","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H20 Br N3 O4 -","- C22 H20 Br N3 O4 -","- C44 H40 Br2 N6 O8 -","2","1","","Xie, Chao-Chao; Tan, Rui; Liu, Yan-Kai","Asymmetric construction of polycyclic indole derivatives with different ring connectivities by an organocatalysis triggered two-step sequence","Organic Chemistry Frontiers","2019","6","7","919","","10.1039/C8QO01406J","","","0.71073","MoKα","","0.0514","0.0326","","","0.066","0.073","","","","","","0.839","","","","has coordinates,has disorder","237377","2020-10-21","18:00:00",""
"1554585","9.6264","0.0013","10.858","0.0014","11.2163","0.0014","90","","113.736","0.002","90","","1073.2","0.2","120.15","","120.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H24 N2 O7 -","- C21 H24 N2 O7 -","- C42 H48 N4 O14 -","2","1","","Xie, Chao-Chao; Tan, Rui; Liu, Yan-Kai","Asymmetric construction of polycyclic indole derivatives with different ring connectivities by an organocatalysis triggered two-step sequence","Organic Chemistry Frontiers","2019","6","7","919","","10.1039/C8QO01406J","","","0.71073","MoKα","","0.0865","0.0496","","","0.0988","0.1161","","","","","","1.057","","","","has coordinates,has disorder","237377","2020-10-21","18:00:00",""
"1554586","11.431","0.006","5.931","0.003","25.849","0.014","90","","94.751","0.01","90","","1746.5","1.6","293","2","293","2","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 F3 N O3 -","- C17 H20 F3 N O3 -","- C68 H80 F12 N4 O12 -","4","1","","Gupta, Ekta; Zaheer, Mohd Khalid; Kant, Ruchir; Mohanan, Kishor","Additive-free regio- and diastereoselective construction of fully-substituted isoxazolidines employing diazo compounds","Organic Chemistry Frontiers","2019","6","8","1109","","10.1039/C8QO01421C","","","0.71075","MoKα","","0.1224","0.0596","","","0.1498","0.1776","","","","","","0.912","","","","has coordinates","237379","2020-10-21","18:00:00",""
"1554587","11.218","0.003","12.296","0.003","16.82","0.005","108.32","0.02","101.98","0.03","102.65","0.02","2051.1","1.1","293","2","293","2","","","","","","","see text","5","P -1","-P 1","2","","","","- C14 H14 F3 N O2 -","- C14 H14 F3 N O2 -","- C84 H84 F18 N6 O12 -","6","3","","Gupta, Ekta; Zaheer, Mohd Khalid; Kant, Ruchir; Mohanan, Kishor","Additive-free regio- and diastereoselective construction of fully-substituted isoxazolidines employing diazo compounds","Organic Chemistry Frontiers","2019","6","8","1109","","10.1039/C8QO01421C","","","0.71075","MoKα","","0.1716","0.0555","","","0.1396","0.1588","","","","","","0.595","","","","has coordinates","237379","2020-10-21","18:00:00",""
"1554694","38.372","0.011","43.842","0.012","41.771","0.012","90","","101.834","0.003","90","","68778","3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C260 H202 Cu4 N16 O23 -","- C260 H202 Cu4 N16 O23 -","- C2080 H1616 Cu32 N128 O184 -","8","2","","Maehara, Takeshi; Sekiya, Ryo; Harada, Kentaro; Haino, Takeharu","Tunable enforced cavities inside self-assembled capsules","Organic Chemistry Frontiers","2019","6","10","1561","","10.1039/C9QO00010K","","","0.71073","MoKα","","0.4241","0.2119","","","0.4543","0.5367","","","","","","1.066","","","","has coordinates","274567","2022-04-19","14:22:36",""
"1554695","10.7588","0.0007","13.1415","0.0008","15.339","0.001","106.956","0.001","100.938","0.001","91.717","0.001","2028.3","0.2","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H40 B Cl4 Cu F4 N4 -","- C40 H40 B Cl4 Cu F4 N4 -","- C80 H80 B2 Cl8 Cu2 F8 N8 -","2","1","","Maehara, Takeshi; Sekiya, Ryo; Harada, Kentaro; Haino, Takeharu","Tunable enforced cavities inside self-assembled capsules","Organic Chemistry Frontiers","2019","6","10","1561","","10.1039/C9QO00010K","","","0.71073","MoKα","","0.0384","0.034","","","0.0882","0.0912","","","","","","1.01","","","","has coordinates","238056","2020-10-21","18:00:00",""
"1554696","9.0064","0.0003","9.7885","0.0003","30.9078","0.0011","90","","90","","90","","2724.81","0.16","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(R)-4-benzyl-4-((S)-(4-chlorophenyl)(2-hydroxy-3-methoxyphenyl)methyl)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one","(R)-4-benzyl-4-((S)-(4-chlorophenyl)(2-hydroxy-3-methoxyphenyl)methyl)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one","","- C31 H29 Cl N2 O4 -","- C31 H29 Cl N2 O4 -","- C124 H116 Cl4 N8 O16 -","4","1","","Chu, Ming-Ming; Qi, Suo-Suo; Ju, Wan-Zhen; Wang, Yi-Feng; Chen, Xue-Yang; Xu, Dan-Qian; Xu, Zhen-Yuan","Asymmetric organocatalytic conjugated addition of pyrazolin-5-ones to ortho-quinomethanes: construction of vicinal tertiary and all-carbon quaternary stereocenters","Organic Chemistry Frontiers","2019","6","8","1140","","10.1039/C9QO00011A","","","0.71073","MoKα","","0.0615","0.0448","","","0.1069","0.1185","","","","","","1.083","","","","has coordinates","238058","2020-10-21","18:00:00",""
"1554697","36.594","0.002","7.353","0.003","28.802","0.003","90","","123.87","0.03","90","","6435","4","90","2","90","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C63.5 H60 N6 O14.5 -","- C63.5 H60 N6 O14.5 -","- C254 H240 N24 O58 -","4","1","","Ren, Demin; Liu, Bin; Li, Xiaofang; Koniarz, Sebastian; Pawlicki, Miłosz; Chmielewski, Piotr J.","Reactions of 2-aza-21-carbaporphyrin with aniline derivatives","Organic Chemistry Frontiers","2019","6","7","908","","10.1039/C9QO00024K","","","0.71073","MoKα","","0.0922","0.0634","","","0.1522","0.1703","","","","","","1.036","","","","has coordinates,has disorder","238060","2020-10-21","18:00:00",""
"1554698","33.74","0.002","12.9479","0.0008","14.8229","0.0008","90","","100.325","0.006","90","","6370.7","0.7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C79 H72 N6 O6 -","- C79 H72 N6 O6 -","- C316 H288 N24 O24 -","4","1","","Ren, Demin; Liu, Bin; Li, Xiaofang; Koniarz, Sebastian; Pawlicki, Miłosz; Chmielewski, Piotr J.","Reactions of 2-aza-21-carbaporphyrin with aniline derivatives","Organic Chemistry Frontiers","2019","6","7","908","","10.1039/C9QO00024K","","","1.54184","CuKα","","0.1186","0.0678","","","0.1572","0.1707","","","","","","0.867","","","","has coordinates,has disorder","238060","2020-10-21","18:00:00",""
"1554699","6.9921","0.0003","11.2113","0.0006","12.4434","0.0007","96.443","0.002","95.376","0.002","95.626","0.002","959.19","0.09","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H16 Br2 F N O3 S -","- C18 H16 Br2 F N O3 S -","- C36 H32 Br4 F2 N2 O6 S2 -","2","1","","Anitha, Mandala; Shankar, Mallepalli; Kumara Swamy, K. C.","Reactivity of epoxy-ynamides with metal halides: nucleophile (Br/Cl/OH)-assisted tandem intramolecular 5-exo-dig or 6-endo-dig cyclisation and AgF2-promoted oxidation","Organic Chemistry Frontiers","2019","6","8","1133","","10.1039/C9QO00027E","","","0.71073","MoKα","","0.0551","0.0479","","","0.1414","0.1485","","","","","","0.897","","","","has coordinates","238063","2020-10-21","18:00:00",""
"1554700","18.258","0.002","13.081","0.0013","15.4466","0.0014","90","","91.845","0.003","90","","3687.2","0.6","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H20 Cl N O3 S -","- C19 H20 Cl N O3 S -","- C152 H160 Cl8 N8 O24 S8 -","8","1","","Anitha, Mandala; Shankar, Mallepalli; Kumara Swamy, K. C.","Reactivity of epoxy-ynamides with metal halides: nucleophile (Br/Cl/OH)-assisted tandem intramolecular 5-exo-dig or 6-endo-dig cyclisation and AgF2-promoted oxidation","Organic Chemistry Frontiers","2019","6","8","1133","","10.1039/C9QO00027E","","","0.71073","MoKα","","0.0535","0.0488","","","0.139","0.1434","","","","","","1.123","","","","has coordinates","238063","2020-10-21","18:00:00",""
"1554701","7.4466","0.0005","24.7338","0.0015","9.6421","0.0005","90","","104.56","0.002","90","","1718.87","0.18","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H14 N2 O7 S -","- C17 H14 N2 O7 S -","- C68 H56 N8 O28 S4 -","4","1","","Anitha, Mandala; Shankar, Mallepalli; Kumara Swamy, K. C.","Reactivity of epoxy-ynamides with metal halides: nucleophile (Br/Cl/OH)-assisted tandem intramolecular 5-exo-dig or 6-endo-dig cyclisation and AgF2-promoted oxidation","Organic Chemistry Frontiers","2019","6","8","1133","","10.1039/C9QO00027E","","","0.71073","MoKα","","0.0624","0.0435","","","0.1037","0.1128","","","","","","1.046","","","","has coordinates","238063","2020-10-21","18:00:00",""
"1554702","10.994","0.013","12.052","0.015","16.9","0.02","95.131","0.011","99.76","0.011","103.107","0.011","2130","4","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H25 N O4 S -","- C21 H25 N O4 S -","- C84 H100 N4 O16 S4 -","4","2","","Anitha, Mandala; Shankar, Mallepalli; Kumara Swamy, K. C.","Reactivity of epoxy-ynamides with metal halides: nucleophile (Br/Cl/OH)-assisted tandem intramolecular 5-exo-dig or 6-endo-dig cyclisation and AgF2-promoted oxidation","Organic Chemistry Frontiers","2019","6","8","1133","","10.1039/C9QO00027E","","","0.71073","MoKα","","0.2175","0.0973","","","0.2554","0.3338","","","","","","0.929","","","","has coordinates","238063","2020-10-21","18:00:00",""
"1554703","8.2985","0.0003","12.4303","0.0006","19.4432","0.0008","90","","101.322","0.001","90","","1966.59","0.14","300","2","300","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Br3 N O2 S -","- C17 H16 Br3 N O2 S -","- C68 H64 Br12 N4 O8 S4 -","4","1","","Anitha, Mandala; Shankar, Mallepalli; Kumara Swamy, K. C.","Reactivity of epoxy-ynamides with metal halides: nucleophile (Br/Cl/OH)-assisted tandem intramolecular 5-exo-dig or 6-endo-dig cyclisation and AgF2-promoted oxidation","Organic Chemistry Frontiers","2019","6","8","1133","","10.1039/C9QO00027E","","","0.71073","MoKα","","0.047","0.0394","","","0.0993","0.1036","","","","","","1.047","","","","has coordinates","238063","2020-10-21","18:00:00",""
"1554704","6.9458","0.0002","10.9848","0.0002","12.6203","0.0004","95.166","0.002","94.677","0.002","97.68","0.002","946.11","0.04","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H14 Br3 N O3 S -","- C17 H14 Br3 N O3 S -","- C34 H28 Br6 N2 O6 S2 -","2","1","","Anitha, Mandala; Shankar, Mallepalli; Kumara Swamy, K. C.","Reactivity of epoxy-ynamides with metal halides: nucleophile (Br/Cl/OH)-assisted tandem intramolecular 5-exo-dig or 6-endo-dig cyclisation and AgF2-promoted oxidation","Organic Chemistry Frontiers","2019","6","8","1133","","10.1039/C9QO00027E","","","0.71073","MoKα","","0.0809","0.0509","","","0.1129","0.1223","","","","","","1.071","","","","has coordinates","238063","2020-10-21","18:00:00",""
"1554705","6.5927","0.0001","24.4163","0.0004","9.1339","0.0002","90","","108.268","0.002","90","","1396.18","0.05","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 F3 N2 O -","- C16 H11 F3 N2 O -","- C64 H44 F12 N8 O4 -","4","1","","Zhu, Chuanle; Liu, Chi; Zeng, Hao; Chen, Fulin; Jiang, Huanfeng","Transition-metal free selective C(α)‒C(β) bond cleavage of trifluoromethyl ketones with amidines under air: facile access to 5-trifluoromethylated Imidazol-4-ones","Organic Chemistry Frontiers","2019","6","6","858","","10.1039/C9QO00029A","","x-ray","1.54184","CuKα","","0.0517","0.047","","","0.1251","0.1316","","","","","","1.048","","","","has coordinates","238065","2020-10-21","18:00:00",""
"1554706","25.9456","0.0005","8.8451","0.0003","23.3704","0.0007","90","","101.146","0.003","90","","5262.1","0.3","293","1","293","1","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C21 H22 Cl N5 O8 -","- C21 H22 Cl N5 O8 -","- C168 H176 Cl8 N40 O64 -","8","2","","Hao, Er-Jun; Fu, Dan-Dan; Wang, Dong-Chao; Zhang, Tao; Qu, Gui-Rong; Li, Gong-Xin; Lan, Yu; Guo, Hai-Ming","Chemoselective asymmetric dearomative [3 + 2] cycloaddition reactions of purines with aminocyclopropanes","Organic Chemistry Frontiers","2019","6","6","863","","10.1039/C9QO00039A","","x-ray","1.54184","CuKα","","0.0667","0.0641","","","0.1749","0.1781","","","","","","1.052","","","","has coordinates","238067","2020-10-21","18:00:00",""
"1554707","14.6444","0.0002","19.027","0.0003","9.2992","0.0001","90","","98.115","0.001","90","","2565.17","0.06","291.42","0.1","291.42","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H26 Cl N5 O9 -","- C22 H26 Cl N5 O9 -","- C88 H104 Cl4 N20 O36 -","4","1","","Hao, Er-Jun; Fu, Dan-Dan; Wang, Dong-Chao; Zhang, Tao; Qu, Gui-Rong; Li, Gong-Xin; Lan, Yu; Guo, Hai-Ming","Chemoselective asymmetric dearomative [3 + 2] cycloaddition reactions of purines with aminocyclopropanes","Organic Chemistry Frontiers","2019","6","6","863","","10.1039/C9QO00039A","","x-ray","1.54184","CuKα","","0.0747","0.0664","","","0.185","0.1976","","","","","","1.048","","","","has coordinates","238067","2020-10-21","18:00:00",""
"1554708","8.9522","0.0004","12.3288","0.0005","12.6211","0.0005","103.938","0.003","101.104","0.004","102.417","0.004","1275.71","0.1","291.69","0.1","291.69","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C25 H22 Cl N5 O8 -","- C25 H22 Cl N5 O8 -","- C50 H44 Cl2 N10 O16 -","2","1","","Hao, Er-Jun; Fu, Dan-Dan; Wang, Dong-Chao; Zhang, Tao; Qu, Gui-Rong; Li, Gong-Xin; Lan, Yu; Guo, Hai-Ming","Chemoselective asymmetric dearomative [3 + 2] cycloaddition reactions of purines with aminocyclopropanes","Organic Chemistry Frontiers","2019","6","6","863","","10.1039/C9QO00039A","","x-ray","0.71073","MoKα","","0.0608","0.0503","","","0.1244","0.1314","","","","","","1.058","","","","has coordinates","238067","2020-10-21","18:00:00",""
"1554709","9.4007","0.0002","10.8468","0.0002","21.7267","0.0005","90","","90","","90","","2215.42","0.08","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H23 Br N2 O4 S -","- C21 H23 Br N2 O4 S -","- C84 H92 Br4 N8 O16 S4 -","4","1","","Shen, Guoli; Khan, Ruhima; Lv, Haiping; Yang, Yong; Zhang, Xia; Zhan, Yong; Zhou, Yongyun; Fan, Baomin","Palladium/silver co-catalyzed syn-stereoselective asymmetric ring-opening reactions of azabenzonorbornadienes with amides","Organic Chemistry Frontiers","2019","6","9","1423","","10.1039/C9QO00041K","","","1.54178","CuKα","","0.0365","0.0364","","","0.0944","0.0946","","","","","","1.087","","","","has coordinates","238069","2020-10-21","18:00:00",""
"1554710","7.4893","0.0009","3.8493","0.0004","19.835","0.002","90","","94.273","0.004","90","","570.23","0.11","110","","110","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H8 F2 S2 -","- C14 H8 F2 S2 -","- C28 H16 F4 S4 -","2","0.5","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","x-ray","0.71073","MoKα","","0.0902","0.0787","","","0.1626","0.1703","","","","","","1.342","","","","has coordinates,has disorder","238072","2020-10-21","18:00:00",""
"1554711","5.9315","0.0006","4.9497","0.0005","18.794","0.002","90","","95.89","0.004","90","","548.86","0.1","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H6 F N2 S2 -","- C12 H6 F N2 S2 -","- C24 H12 F2 N4 S4 -","2","0.5","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","x-ray","0.71073","MoKα","","0.0928","0.0818","","","0.1515","0.159","","","","","","1.174","","","","has coordinates,has disorder","238072","2020-10-21","18:00:00",""
"1554712","5.7427","0.0003","5.5541","0.0003","17.1753","0.0008","90","","90.509","0.002","90","","547.79","0.05","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H6 F2 N2 S2 -","- C12 H6 F2 N2 S2 -","- C24 H12 F4 N4 S4 -","2","0.5","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","x-ray","1.54178","CuKα","","0.035","0.0315","","","0.0832","0.085","","","","","","1.092","","","","has coordinates","238072","2020-10-21","18:00:00",""
"1554713","6.2999","0.0003","5.0655","0.0003","18.6515","0.0011","90","","90.341","0.002","90","","595.2","0.06","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H6 F4 S2 -","- C14 H6 F4 S2 -","- C28 H12 F8 S4 -","2","0.5","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","","1.54178","CuKα","","0.0472","0.0429","","","0.1048","0.107","","","","","","1.147","","","","has coordinates","238072","2020-10-21","18:00:00",""
"1554714","9.3302","0.0004","12.3529","0.0005","14.5826","0.0005","90","","106.185","0.001","90","","1614.11","0.11","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H46 F N2 S2 Si2 -","- C30 H46 F N2 S2 Si2 -","- C60 H92 F2 N4 S4 Si4 -","2","0.5","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","","1.54178","CuKα","","0.0331","0.0296","","","0.0737","0.0757","","","","","","1.085","","","","has coordinates","238072","2020-10-21","18:00:00",""
"1554715","9.2882","0.0002","12.3511","0.0003","14.5307","0.0004","90","","105.826","0.001","90","","1603.77","0.07","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H48 N2 S2 Si2 -","- C30 H48 N2 S2 Si2 -","- C60 H96 N4 S4 Si4 -","2","0.5","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","","1.54178","CuKα","","0.0422","0.0363","","","0.0877","0.0915","","","","","","1.056","","","","has coordinates","238072","2020-10-21","18:00:00",""
"1554716","5.0225","0.0008","7.1949","0.0014","17.29","0.003","84.549","0.003","83.096","0.002","70.873","0.002","584.99","0.18","110","","110","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H4 F4 N2 S2 -","- C12 H4 F4 N2 S2 -","- C24 H8 F8 N4 S4 -","2","1","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","","0.71073","MoKα","","0.0294","0.0266","","","0.066","0.0681","","","","","","1.04","","","","has coordinates","238072","2020-10-21","18:00:00",""
"1554717","9.3622","0.0003","12.3591","0.0004","14.6437","0.0004","90","","106.674","0.001","90","","1623.15","0.09","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H46 F2 N2 S2 Si2 -","- C30 H46 F2 N2 S2 Si2 -","- C60 H92 F4 N4 S4 Si4 -","2","0.5","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","","1.54178","CuKα","","0.0311","0.0282","","","0.0717","0.0738","","","","","","1.075","","","","has coordinates","238072","2020-10-21","18:00:00",""
"1554718","3.8093","0.0003","6.6644","0.0004","21.5126","0.0015","90","","94.338","0.004","90","","544.57","0.07","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H5 F N2 S2 -","- C12 H5 F N2 S2 -","- C24 H10 F2 N4 S4 -","2","0.5","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","","1.54178","CuKα","","0.0979","0.0846","","","0.1564","0.1609","","","","","","1.314","","","","has coordinates,has disorder","238072","2020-10-21","18:00:00",""
"1554719","19.9633","0.0007","12.2859","0.0004","13.3676","0.0005","90","","90","","90","","3278.6","0.2","100","","100","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C30 H44 F4 N2 S2 Si2 -","- C30 H44 F4 N2 S2 Si2 -","- C120 H176 F16 N8 S8 Si8 -","4","1","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","","1.54178","CuKα","","0.0235","0.0222","","","0.0557","0.0563","","","","","","1.068","","","","has coordinates","238072","2020-10-21","18:00:00",""
"1554720","6.6214","0.0004","25.6046","0.0015","7.2049","0.0004","90","","116.456","0.004","90","","1093.59","0.12","110","","110","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H6 F2 N2 S2 -","- C12 H6 F2 N2 S2 -","- C48 H24 F8 N8 S8 -","4","1","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","","1.54178","CuKα","","0.0631","0.0591","","","0.1451","0.1468","","","","","","1.244","","","","has coordinates","238072","2020-10-21","18:00:00",""
"1554721","3.8531","0.0006","23.868","0.003","6.121","0.0009","90","","95.29","0.003","90","","560.53","0.14","110","","110","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H4 F4 N2 S2 -","- C12 H4 F4 N2 S2 -","- C24 H8 F8 N4 S4 -","2","0.5","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","","0.71073","MoKα","","0.032","0.0301","","","0.0761","0.0773","","","","","","1.079","","","","has coordinates","238072","2020-10-21","18:00:00",""
"1554722","15.9825","0.0007","9.7302","0.0004","13.6524","0.0004","90","","90","","90","","2123.12","0.14","100","","100","","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C12 H8 N2 S2 -","- C12 H8 N2 S2 -","- C96 H64 N16 S16 -","8","0.5","","Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed","Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives","Organic Chemistry Frontiers","2019","6","6","780","","10.1039/C9QO00044E","","","1.54178","CuKα","","0.0265","0.0256","","","0.0616","0.0621","","","","","","1.104","","","","has coordinates,has disorder","238072","2020-10-21","18:00:00",""
"1554723","10.2239","0.0005","11.009","0.0006","11.0538","0.0006","73.729","0.005","86.05","0.005","65.798","0.005","1087.85","0.11","100","0.1","100","0.1","","","","","","","","3","P -1","-P 1","2","","","","- C29 H28 O2 -","- C29 H28 O2 -","- C58 H56 O4 -","2","1","","Zhang, He; Cao, Tongxiang; Luo, Hejiang; Chen, Lianfen; Zhu, Shifa","Enynone-enabled migratory insertion and Schmittel cyclization cascade for the synthesis of furan-fused fluorenes","Organic Chemistry Frontiers","2019","6","8","1118","","10.1039/C9QO00045C","","x-ray","0.71073","MoKα","","0.0577","0.0458","","","0.1096","0.1198","","","","","","1.043","","","","has coordinates","238075","2020-10-21","18:00:00",""
"1554724","11.5269","0.0006","6.9766","0.0004","23.812","0.0012","90","","98.369","0.005","90","","1894.54","0.18","100.01","0.1","100.01","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 O3 -","- C26 H20 O3 -","- C104 H80 O12 -","4","1","","Zhang, He; Cao, Tongxiang; Luo, Hejiang; Chen, Lianfen; Zhu, Shifa","Enynone-enabled migratory insertion and Schmittel cyclization cascade for the synthesis of furan-fused fluorenes","Organic Chemistry Frontiers","2019","6","8","1118","","10.1039/C9QO00045C","","x-ray","0.71073","MoKα","","0.0474","0.0398","","","0.0945","0.0991","","","","","","1.084","","","","has coordinates","238075","2020-10-21","18:00:00",""
"1554725","22.035","0.012","15.426","0.007","17.593","0.01","90","","121.518","0.007","90","","5098","5","273","2","273","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","C60(OCH2CH2F)8","","- C76 H32 F8 O8 -","- C76 H32 F8 O8 -","- C304 H128 F32 O32 -","4","0.5","","Ma, Yue; Uchiyama, Kouya; Ueno, Hiroshi; Okada, Hiroshi; Moriyama, Hiroshi; Matsuo, Yutaka","Highly soluble C2v-symmetrical fullerene derivatives: efficient synthesis, characterization, and electrochemical study","Organic Chemistry Frontiers","2019","6","9","1372","","10.1039/C9QO00056A","","x-ray","0.71073","MoKα","","0.1435","0.0915","","","0.1406","0.1721","","","","","","1.054","","","","has coordinates","238077","2020-10-21","18:00:00",""
"1554726","21.782","","13.957","","24.511","","90","","110.66","","90","","6972.41","","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","C60(OCH2CCl3)8","","- C76 H16 Cl24 O8 -","- C76 H16 Cl24 O8 -","- C304 H64 Cl96 O32 -","4","1","","Ma, Yue; Uchiyama, Kouya; Ueno, Hiroshi; Okada, Hiroshi; Moriyama, Hiroshi; Matsuo, Yutaka","Highly soluble C2v-symmetrical fullerene derivatives: efficient synthesis, characterization, and electrochemical study","Organic Chemistry Frontiers","2019","6","9","1372","","10.1039/C9QO00056A","","x-ray","0.71073","MoKα","","0.1543","0.1397","","","0.318","0.3292","","","","","","1.1","","","","has coordinates,has disorder","238077","2020-10-21","18:00:00",""
"1554727","5.0429","0.001","11.88","0.002","25.83","0.005","90","","90","","90","","1547.5","0.5","173.15","","173.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 Br N O4 -","- C15 H18 Br N O4 -","- C60 H72 Br4 N4 O16 -","4","1","","Hu, Hui-Juan; Chen, Peng; Ao, Yu-Fei; Wang, Qi-Qiang; Wang, De-Xian; Wang, Mei-Xiang","Highly efficient biocatalytic desymmetrization of meso carbocyclic 1,3-dicarboxamides: a versatile route for enantiopure 1,3-disubstituted cyclohexanes and cyclopentanes","Organic Chemistry Frontiers","2019","6","6","808","","10.1039/C9QO00069K","","","0.710747","MoKα","","0.0274","0.026","","","0.0573","0.0583","","","","","","1.066","","","","has coordinates","238079","2020-10-21","18:00:00",""
"1554728","6.5631","0.0014","12.796","0.003","18.385","0.004","90","","90","","90","","1544","0.6","173","2","173.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 Br N O4 -","- C15 H18 Br N O4 -","- C60 H72 Br4 N4 O16 -","4","1","","Hu, Hui-Juan; Chen, Peng; Ao, Yu-Fei; Wang, Qi-Qiang; Wang, De-Xian; Wang, Mei-Xiang","Highly efficient biocatalytic desymmetrization of meso carbocyclic 1,3-dicarboxamides: a versatile route for enantiopure 1,3-disubstituted cyclohexanes and cyclopentanes","Organic Chemistry Frontiers","2019","6","6","808","","10.1039/C9QO00069K","","","0.71073","MoKα","","0.0529","0.0457","","","0.0763","0.0794","","","","","","1.147","","","","has coordinates","238079","2020-10-21","18:00:00",""
"1554729","16.191","0.002","17.7337","0.0007","8.5986","0.0011","90","","137.72","0.03","90","","1661","1","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C20 H17 O2 P -","- C20 H17 O2 P -","- C80 H68 O8 P4 -","4","1","","Zhao, Xiuli; Huang, Mengmeng; Li, Yabo; Zhang, Jianye; Kim, Jung Keun; Wu, Yangjie","Stepwise photosensitized C(sp3)‒C(CO) bond cleavage and C‒P bond formation of 1,3-dicarbonyls with arylphosphine oxides","Organic Chemistry Frontiers","2019","6","9","1433","","10.1039/C9QO00075E","","x-ray","1.54184","CuKα","","0.0405","0.0374","","","0.0923","0.0969","","","","","","1.072","","","","has coordinates","238081","2020-10-21","18:00:00",""
"1554730","12.1117","0.001","15.5259","0.0012","21.575","0.0018","95.307","0.003","97.116","0.003","101.212","0.002","3920.6","0.6","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H25 Cl O2 -","- C34 H25 Cl O2 -","- C204 H150 Cl6 O12 -","6","3","","Sun, Jing; Jiang, Wang; Yan, Chao-Guo","Convenient construction of dibenzo[b,d]furanes and 2,6-diaryl-4-(2-hydroxyphenyl)pyridines via domino reaction of pyridinium ylides with 2-aryl-3-nitrochromenes","Organic Chemistry Frontiers","2019","6","9","1428","","10.1039/C9QO00079H","","","0.71073","MoKα","","0.1596","0.0874","","","0.2316","0.267","","","","","","1.056","","","","has coordinates","238084","2020-10-21","18:00:00",""
"1554731","10.7141","0.0009","20.1653","0.0017","12.3094","0.0013","90","","107.329","0.003","90","","2538.8","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H20 N2 O6 -","- C32 H20 N2 O6 -","- C128 H80 N8 O24 -","4","1","","Sun, Jing; Jiang, Wang; Yan, Chao-Guo","Convenient construction of dibenzo[b,d]furanes and 2,6-diaryl-4-(2-hydroxyphenyl)pyridines via domino reaction of pyridinium ylides with 2-aryl-3-nitrochromenes","Organic Chemistry Frontiers","2019","6","9","1428","","10.1039/C9QO00079H","","","0.71073","MoKα","","0.1205","0.0617","","","0.1276","0.1499","","","","","","1.02","","","","has coordinates,has disorder","238084","2020-10-21","18:00:00",""
"1554732","10.602","0.0012","20.505","0.002","12.2951","0.0013","90","","114.94","0.003","90","","2423.6","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H21 Br O2 -","- C32 H21 Br O2 -","- C128 H84 Br4 O8 -","4","1","","Sun, Jing; Jiang, Wang; Yan, Chao-Guo","Convenient construction of dibenzo[b,d]furanes and 2,6-diaryl-4-(2-hydroxyphenyl)pyridines via domino reaction of pyridinium ylides with 2-aryl-3-nitrochromenes","Organic Chemistry Frontiers","2019","6","9","1428","","10.1039/C9QO00079H","","","0.71073","MoKα","","0.0894","0.0454","","","0.0939","0.1076","","","","","","1.026","","","","has coordinates","238084","2020-10-21","18:00:00",""
"1554733","9.998","0.007","15.063","0.011","15.716","0.011","63.252","0.013","83.527","0.015","76.536","0.016","2055","3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H19 Cl O -","- C26 H19 Cl O -","- C104 H76 Cl4 O4 -","4","2","","Sun, Jing; Jiang, Wang; Yan, Chao-Guo","Convenient construction of dibenzo[b,d]furanes and 2,6-diaryl-4-(2-hydroxyphenyl)pyridines via domino reaction of pyridinium ylides with 2-aryl-3-nitrochromenes","Organic Chemistry Frontiers","2019","6","9","1428","","10.1039/C9QO00079H","","","0.71073","MoKα","","0.4157","0.1326","","","0.2689","0.3894","","","","","","1.006","","","","has coordinates","238084","2020-10-21","18:00:00",""
"1554734","13.3814","0.001","10.6318","0.0008","19.2274","0.0016","90","","92.604","0.003","90","","2732.6","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H25 Br O4 -","- C34 H25 Br O4 -","- C136 H100 Br4 O16 -","4","1","","Sun, Jing; Jiang, Wang; Yan, Chao-Guo","Convenient construction of dibenzo[b,d]furanes and 2,6-diaryl-4-(2-hydroxyphenyl)pyridines via domino reaction of pyridinium ylides with 2-aryl-3-nitrochromenes","Organic Chemistry Frontiers","2019","6","9","1428","","10.1039/C9QO00079H","","","0.71073","MoKα","","0.1384","0.0531","","","0.1044","0.1301","","","","","","1.006","","","","has coordinates","238084","2020-10-21","18:00:00",""
"1554735","9.3743","0.0005","13.379","0.0007","14.9327","0.0008","81.008","0.001","89.658","0.001","80.276","0.001","1822.85","0.17","120","","120","","","","","","","","","6","P 1","P 1","1","","","","- C32 H33 Cl3 N4 Ni O4 -","- C32 H33 Cl3 N4 Ni O4 -","- C64 H66 Cl6 N8 Ni2 O8 -","2","2","","Larionov, Vladimir A.; Stoletova, Nadezhda V.; Kovalev, Vladislav I.; Smol'yakov, Alexander F.; Savel'yeva, Tat'yana F.; Maleev, Victor I.","A general synthesis of unnatural α-amino acids by iron-catalysed olefin‒olefin coupling via generated radicals","Organic Chemistry Frontiers","2019","6","8","1094","","10.1039/C9QO00108E","","","0.71073","MoKα","","0.0609","0.0545","","","0.146","0.1513","","","","","","1.037","","","","has coordinates,has disorder","238086","2020-10-21","18:00:00",""
"1554736","9.846","0.0004","12.0451","0.0005","14.2648","0.0006","90","","110.181","0.001","90","","1587.89","0.11","120","","120","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18.5 H19.5 N1.5 Ni0.5 O2 -","- C18.5 H19.5 N1.5 Ni0.5 O2 -","- C74 H78 N6 Ni2 O8 -","4","2","","Larionov, Vladimir A.; Stoletova, Nadezhda V.; Kovalev, Vladislav I.; Smol'yakov, Alexander F.; Savel'yeva, Tat'yana F.; Maleev, Victor I.","A general synthesis of unnatural α-amino acids by iron-catalysed olefin‒olefin coupling via generated radicals","Organic Chemistry Frontiers","2019","6","8","1094","","10.1039/C9QO00108E","","","0.71073","MoKα","","0.045","0.0372","","","0.0864","0.0899","","","","","","1.005","","","","has coordinates,has disorder","238086","2020-10-21","18:00:00",""
"1554737","11.452","0.0009","13.8346","0.0012","22.8016","0.0019","90","","90","","90","","3612.5","0.5","120","","120","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H39 Cl4 N3 Ni O3 -","- C36 H39 Cl4 N3 Ni O3 -","- C144 H156 Cl16 N12 Ni4 O12 -","4","1","","Larionov, Vladimir A.; Stoletova, Nadezhda V.; Kovalev, Vladislav I.; Smol'yakov, Alexander F.; Savel'yeva, Tat'yana F.; Maleev, Victor I.","A general synthesis of unnatural α-amino acids by iron-catalysed olefin‒olefin coupling via generated radicals","Organic Chemistry Frontiers","2019","6","8","1094","","10.1039/C9QO00108E","","","0.71073","MoKα","","0.0869","0.0634","","","0.1587","0.1773","","","","","","1.031","","","","has coordinates","238086","2020-10-21","18:00:00",""
"1554738","5.459","0.0003","7.8884","0.0003","51.7461","0.0018","90","","90","","90","","2228.33","0.17","295","2","295.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H27 Br O3 -","- C24 H27 Br O3 -","- C96 H108 Br4 O12 -","4","1","","Xin, Xiaodong; Pan, Xinhui; Meng, Zhilin; Liu, Xigong; Liu, Lei","Catalytic enantioselective cross-dehydrogenative coupling of 3,6-dihydro-2H-pyrans with aldehydes","Organic Chemistry Frontiers","2019","6","9","1448","","10.1039/C9QO00123A","","x-ray","1.54184","CuKα","","0.0752","0.068","","","0.1962","0.2027","","","","","","1.055","","","","has coordinates","238088","2020-10-21","18:00:00",""
"1554739","12.1948","0.0012","18.8246","0.001","10.1822","0.0008","90","","105.486","0.009","90","","2252.6","0.3","293","2","293.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H19 Br N2 O3 S -","- C23 H19 Br N2 O3 S -","- C92 H76 Br4 N8 O12 S4 -","4","1","","Xu, Ze-Feng; Shan, Lihong; Zhang, Wan; Cen, Mengjie; Li, Chuan-Ying","Synthesis of α-aminoketones from N-sulfonyl-1,2,3-triazoles via N-sulfinyl imines generated by intramolecular oxygen transfer","Organic Chemistry Frontiers","2019","6","9","1391","","10.1039/C9QO00126C","","","0.71073","MoKα","","0.0601","0.041","","","0.0929","0.1025","","","","","","1.041","","","","has coordinates","238089","2020-10-21","18:00:00",""
"1554740","17.41181","0.00011","27.6471","0.00016","17.61491","0.00011","90","","90","","90","","8479.57","0.09","100","0.1","100","0.1","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C43 H36 N4 O9 -","- C43 H36 N4 O9 -","- C344 H288 N32 O72 -","8","1","","Liu, Xiong-Li; Gong, Yi; Chen, Shuang; Zuo, Xiong; Yao, Zhen; Zhou, Ying","Bifunctional oxindole-chromone 4C building block directed asymmetric synthesis of bispirocyclic hexahydroxanthones featuring five contiguous stereocenters and two side-by-side oxindoles","Organic Chemistry Frontiers","2019","6","10","1603","","10.1039/C9QO00127A","","x-ray","1.54184","CuKα","","0.0335","0.0331","","","0.0899","0.0905","","","","","","1.057","","","","has coordinates","238091","2020-10-21","18:00:00",""
"1554741","29.1304","0.0003","17.2687","0.0001","17.7328","0.0001","90","","103.665","0.001","90","","8667.88","0.12","100","0.1","100","0.1","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C40 H37.5 N4 O9 -","- C40 H37.5 N4 O9 -","- C320 H300 N32 O72 -","8","2","","Liu, Xiong-Li; Gong, Yi; Chen, Shuang; Zuo, Xiong; Yao, Zhen; Zhou, Ying","Bifunctional oxindole-chromone 4C building block directed asymmetric synthesis of bispirocyclic hexahydroxanthones featuring five contiguous stereocenters and two side-by-side oxindoles","Organic Chemistry Frontiers","2019","6","10","1603","","10.1039/C9QO00127A","","x-ray","1.54184","CuKα","","0.0509","0.0499","","","0.1465","0.1481","","","","","","1.08","","","","has coordinates","238091","2020-10-21","18:00:00",""
"1554742","8.1722","0.0005","16.0848","0.0007","9.1272","0.0006","90","","95.0903","0.0016","90","","1195.02","0.12","123","","123","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C31 H26 Cl2 Hf -","- C31 H26 Cl2 Hf -","- C62 H52 Cl4 Hf2 -","2","0.5","","Amaya, Toru; Katoh, Shun; Moriuchi, Toshiyuki; Hirao, Toshikazu","Synthesis of a sumanenyl hafnocene complex","Organic Chemistry Frontiers","2019","6","7","1032","","10.1039/C9QO00140A","","","0.71075","MoKα","","0.0464","0.0326","","","0.0619","0.0847","","","","","","1.234","","","","has coordinates","238093","2020-10-21","18:00:00",""
"1554743","7.272","0.0015","12.369","0.003","12.296","0.003","90","","105.99","0.03","90","","1063.2","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C24 H34 O6 -","- C24 H34 O6 -","- C48 H68 O12 -","2","1","","Xu, Pengfei; Luan, Hongyu; Yu, Bin; Tu, Yongrui; Sun, Yongqiang; Chen, Wei; Xu, Xi; Ge, Raoling; Wang, Jubo; Li, Zhiyu; Bian, Jinlei","Synthesis and characterization of potential stereoisomeric and degradation impurities of ulipristal acetate","Organic Chemistry Frontiers","2019","6","6","868","","10.1039/C9QO00144A","","","0.71073","MoKα","","0.1439","0.0602","","","0.0651","0.0808","","","","","","0.954","","","","has coordinates","238094","2020-10-21","18:00:00",""
"1554744","17.407","0.003","17.407","0.003","17.977","0.004","90","","90","","120","","4717.3","1.6","293","2","293","2","","","","","","","","4","P 65","P 65","170","","","","- C30 H43 N O7 -","- C30 H43 N O7 -","- C180 H258 N6 O42 -","6","1","","Xu, Pengfei; Luan, Hongyu; Yu, Bin; Tu, Yongrui; Sun, Yongqiang; Chen, Wei; Xu, Xi; Ge, Raoling; Wang, Jubo; Li, Zhiyu; Bian, Jinlei","Synthesis and characterization of potential stereoisomeric and degradation impurities of ulipristal acetate","Organic Chemistry Frontiers","2019","6","6","868","","10.1039/C9QO00144A","","","0.71073","MoKα","","0.2159","0.0896","","","0.1926","0.2444","","","","","","1.08","","","","has coordinates","238094","2020-10-21","18:00:00",""
"1554745","7.323","0.0015","12.384","0.003","12.233","0.002","90","","106.42","0.03","90","","1064.1","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C24 H34 O5 -","- C24 H34 O5 -","- C48 H68 O10 -","2","1","","Xu, Pengfei; Luan, Hongyu; Yu, Bin; Tu, Yongrui; Sun, Yongqiang; Chen, Wei; Xu, Xi; Ge, Raoling; Wang, Jubo; Li, Zhiyu; Bian, Jinlei","Synthesis and characterization of potential stereoisomeric and degradation impurities of ulipristal acetate","Organic Chemistry Frontiers","2019","6","6","868","","10.1039/C9QO00144A","","","0.71073","MoKα","","0.0928","0.059","","","0.1519","0.1751","","","","","","1.027","","","","has coordinates","238094","2020-10-21","18:00:00",""
"1554746","10.391","0.002","12.429","0.003","18.269","0.004","90","","90","","90","","2359.4","0.9","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H35 N O3 -","- C28 H35 N O3 -","- C112 H140 N4 O12 -","4","1","","Xu, Pengfei; Luan, Hongyu; Yu, Bin; Tu, Yongrui; Sun, Yongqiang; Chen, Wei; Xu, Xi; Ge, Raoling; Wang, Jubo; Li, Zhiyu; Bian, Jinlei","Synthesis and characterization of potential stereoisomeric and degradation impurities of ulipristal acetate","Organic Chemistry Frontiers","2019","6","6","868","","10.1039/C9QO00144A","","","0.71073","MoKα","","0.1157","0.0623","","","0.139","0.1676","","","","","","1.003","","","","has coordinates","238094","2020-10-21","18:00:00",""
"1554747","13.0109","0.0008","11.5329","0.0005","16.1284","0.0009","90","","109.629","0.006","90","","2279.5","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H17 Cl3 N2 O2 S -","- C25 H17 Cl3 N2 O2 S -","- C100 H68 Cl12 N8 O8 S4 -","4","1","","Wang, Shengzheng; Guo, Zhongjie; Wu, Ying; Liu, Wei; Liu, Xueying; Zhang, Shengyong; Sheng, Chunquan","Organocatalytic asymmetric synthesis of highly functionalized spiro-thiazolone‒cyclopropane-oxindoles bearing two vicinal spiro quaternary centers","Organic Chemistry Frontiers","2019","6","9","1442","","10.1039/C9QO00145J","","","1.54184","CuKα","","0.1366","0.1264","","","0.3338","0.338","","","","","","1.073","","","","has coordinates,has disorder","238096","2020-10-21","18:00:00",""
"1554748","13.41045","0.0001","13.41045","0.0001","40.0935","0.0005","90","","90","","90","","7210.42","0.12","120","0.16","120","0.16","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C40 H34 I3 N3 -","- C40 H34 I3 N3 -","- C320 H272 I24 N24 -","8","1","","Anhäuser, J.; Puttreddy, R.; Lorenz, Y.; Schneider, A.; Engeser, M.; Rissanen, K.; Lützen, A.","Chiral self-sorting behaviour of [2.2]paracyclophane-based bis(pyridine) ligands","Organic Chemistry Frontiers","2019","6","8","1226","","10.1039/C9QO00155G","","x-ray","0.71073","MoKα","","0.0551","0.0448","","","0.1136","0.1189","","","","","","1.106","","","","has coordinates","238098","2020-10-21","18:00:00",""
"1554749","32.9899","0.0005","32.9899","0.0005","14.3593","0.0004","90","","90","","90","","15627.7","0.5","120.01","0.1","120.01","0.1","","","","","","","","6","P 42 21 2","P 4n 2n","94","","","","- C152 H120 B4 F16 N8 Pd2 -","- C152 H120 B4 F16 N8 Pd2 -","- C608 H480 B16 F64 N32 Pd8 -","4","0.5","","Anhäuser, J.; Puttreddy, R.; Lorenz, Y.; Schneider, A.; Engeser, M.; Rissanen, K.; Lützen, A.","Chiral self-sorting behaviour of [2.2]paracyclophane-based bis(pyridine) ligands","Organic Chemistry Frontiers","2019","6","8","1226","","10.1039/C9QO00155G","","x-ray","1.54184","CuKα","","0.0997","0.0861","","","0.2445","0.2598","","","","","","1.031","","","","has coordinates,has disorder","238098","2020-10-21","18:00:00",""
"1554750","46.6905","0.0008","26.3232","0.0003","31.9982","0.0005","90","","97.75","0.002","90","","38968","1","120.01","0.1","120.01","0.1","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C280 H248 F24 N8 O27 P8 Pd4 S8 -","- C280 H248 F24 N8 O27 P8 Pd4 S8 -","- C1120 H992 F96 N32 O108 P32 Pd16 S32 -","4","0.5","","Anhäuser, J.; Puttreddy, R.; Lorenz, Y.; Schneider, A.; Engeser, M.; Rissanen, K.; Lützen, A.","Chiral self-sorting behaviour of [2.2]paracyclophane-based bis(pyridine) ligands","Organic Chemistry Frontiers","2019","6","8","1226","","10.1039/C9QO00155G","","x-ray","1.54184","CuKα","","0.0992","0.0815","","","0.2423","0.2681","","","","","","1.033","","","","has coordinates,has disorder","238098","2020-10-21","18:00:00",""
"1554751","12.4931","0.0005","18.1989","0.0007","20.9673","0.0008","89.537","0.002","87.89","0.003","72.498","0.002","4543.3","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C62 H74 N22 Na O21 S2 -","- C62 H74 N22 Na O21 S2 -","- C124 H148 N44 Na2 O42 S4 -","2","1","","Bauer, Daniel; Andrae, Beatrice; Gaß, Patrick; Trenz, Danjano; Becker, Sabine; Kubik, Stefan","Functionalisable acyclic cucurbiturils","Organic Chemistry Frontiers","2019","6","10","1555","","10.1039/C9QO00156E","","","1.54178","CuKα","","0.189","0.1246","","","0.282","0.3217","","","","","","1.037","","","","has coordinates,has disorder","238100","2020-10-21","18:00:00",""
"1554752","19.1042","0.0009","43.808","0.002","23.0275","0.0011","90","","90","","90","","19272.1","1.6","100","2","100","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C64 H72 Cl2 N18 Na2 O19 S2 -","- C64 H72 Cl2 N18 Na2 O19 S2 -","- C512 H576 Cl16 N144 Na16 O152 S16 -","8","1","","Bauer, Daniel; Andrae, Beatrice; Gaß, Patrick; Trenz, Danjano; Becker, Sabine; Kubik, Stefan","Functionalisable acyclic cucurbiturils","Organic Chemistry Frontiers","2019","6","10","1555","","10.1039/C9QO00156E","","","1.54178","CuKα","","0.1383","0.1112","","","0.3068","0.3181","","","","","","2.172","","","","has coordinates,has disorder","238100","2020-10-21","18:00:00",""
"1554754","17.6358","0.0009","25.0174","0.0012","26.064","0.0013","90","","109.616","0.002","90","","10832.1","0.9","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C108 H150 F12 N2 O18 P2 -","- C108 H150 F12 N2 O18 P2 -","- C432 H600 F48 N8 O72 P8 -","4","1","","Li, Dong-Hao; Yang, Liu-Pan; Chai, Hongxin; Jia, Fei; Ke, Hua; Jiang, Wei","Temperature-induced large amplitude conformational change in the complex of oxatub[4]arene revealed via rotaxane synthesis","Organic Chemistry Frontiers","2019","6","7","1027","","10.1039/C9QO00159J","","","1.54178","CuKα","","0.0681","0.0598","","","0.1741","0.1847","","","","","","1.052","","","","has coordinates,has disorder","238102","2020-10-21","18:00:00",""
"1554757","12.1293","0.0006","8.5068","0.0004","15.8667","0.0009","90","","92.925","0.005","90","","1635.02","0.15","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H11 F5 N2 O2 -","- C19 H11 F5 N2 O2 -","- C76 H44 F20 N8 O8 -","4","1","","Song, Zehua; Wang, Guotong; Li, Wei; Li, Shengkun","Innate pharmacophore assisted selective C‒H functionalization to therapeutically important nicotinamides","Organic Chemistry Frontiers","2019","6","10","1613","","10.1039/C9QO00170K","","x-ray","0.71073","MoKα","","0.0718","0.0499","","","0.1058","0.1188","","","","","","1.032","","","","has coordinates","238105","2020-10-21","18:00:00",""
"1554758","7.886","0.0004","9.5658","0.0007","11.4661","0.0007","86.429","0.005","79.097","0.005","77.958","0.006","830.42","0.09","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C19 H20 N4 O3 -","- C19 H20 N4 O3 -","- C38 H40 N8 O6 -","2","1","","Song, Zehua; Wang, Guotong; Li, Wei; Li, Shengkun","Innate pharmacophore assisted selective C‒H functionalization to therapeutically important nicotinamides","Organic Chemistry Frontiers","2019","6","10","1613","","10.1039/C9QO00170K","","x-ray","1.54184","CuKα","","0.041","0.0396","","","0.1037","0.1047","","","","","","1.088","","","","has coordinates","238105","2020-10-21","18:00:00",""
"1554759","8.0444","0.001","10.7234","0.0012","11.5467","0.0013","71.104","0.01","70.41","0.011","73.474","0.01","870.38","0.19","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C21 H16 Cl N3 O3 -","- C21 H16 Cl N3 O3 -","- C42 H32 Cl2 N6 O6 -","2","1","","Song, Zehua; Wang, Guotong; Li, Wei; Li, Shengkun","Innate pharmacophore assisted selective C‒H functionalization to therapeutically important nicotinamides","Organic Chemistry Frontiers","2019","6","10","1613","","10.1039/C9QO00170K","","x-ray","0.71073","MoKα","","0.0759","0.0561","","","0.1276","0.1414","","","","","","1.037","","","","has coordinates","238105","2020-10-21","18:00:00",""
"1554760","7.7358","0.0005","9.6039","0.0006","11.631","0.0007","85.647","0.005","76.146","0.005","78.816","0.005","822.65","0.09","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C19 H20 N4 O3 -","- C19 H20 N4 O3 -","- C38 H40 N8 O6 -","2","1","","Song, Zehua; Wang, Guotong; Li, Wei; Li, Shengkun","Innate pharmacophore assisted selective C‒H functionalization to therapeutically important nicotinamides","Organic Chemistry Frontiers","2019","6","10","1613","","10.1039/C9QO00170K","","x-ray","0.71073","MoKα","","0.0588","0.0458","","","0.1048","0.1137","","","","","","1.033","","","","has coordinates","238105","2020-10-21","18:00:00",""
"1554761","8.7562","0.0001","23.4732","0.0003","8.8632","0.0002","90","","92.21","0.002","90","","1820.35","0.05","150","0.1","150","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H19 N3 O4 -","- C22 H19 N3 O4 -","- C88 H76 N12 O16 -","4","1","","Song, Zehua; Wang, Guotong; Li, Wei; Li, Shengkun","Innate pharmacophore assisted selective C‒H functionalization to therapeutically important nicotinamides","Organic Chemistry Frontiers","2019","6","10","1613","","10.1039/C9QO00170K","","x-ray","1.54184","CuKα","","0.0435","0.0382","","","0.0967","0.099","","","","","","1.094","","","","has coordinates","238105","2020-10-21","18:00:00",""
"1554762","7.3959","0.0004","19.3566","0.0012","12.7098","0.0009","90","","91.147","0.006","90","","1819.2","0.2","99.99","0.1","99.99","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 Cl F N3 O3 -","- C21 H15 Cl F N3 O3 -","- C84 H60 Cl4 F4 N12 O12 -","4","1","","Song, Zehua; Wang, Guotong; Li, Wei; Li, Shengkun","Innate pharmacophore assisted selective C‒H functionalization to therapeutically important nicotinamides","Organic Chemistry Frontiers","2019","6","10","1613","","10.1039/C9QO00170K","","x-ray","0.71073","MoKα","","0.0575","0.0445","","","0.1002","0.1079","","","","","","1.048","","","","has coordinates","238105","2020-10-21","18:00:00",""
"1554763","15.9357","0.0008","13.7866","0.0008","11.8725","0.0007","90","","93.908","0.005","90","","2602.3","0.3","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H19 F6 N3 O4 -","- C29 H19 F6 N3 O4 -","- C116 H76 F24 N12 O16 -","4","1","","Song, Zehua; Wang, Guotong; Li, Wei; Li, Shengkun","Innate pharmacophore assisted selective C‒H functionalization to therapeutically important nicotinamides","Organic Chemistry Frontiers","2019","6","10","1613","","10.1039/C9QO00170K","","x-ray","0.71073","MoKα","","0.0902","0.0643","","","0.15","0.1664","","","","","","1.071","","","","has coordinates","238105","2020-10-21","18:00:00",""
"1554766","15.267","0.009","19.087","0.01","24.39","0.015","87.94","0.03","83.839","0.018","73.08","0.02","6760","7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H78 Cl2 N4 O16 -","- C60 H78 Cl2 N4 O16 -","- C240 H312 Cl8 N16 O64 -","4","2","","Jordan, Jacobs H.; Wishard, Anthony; Mague, Joel T.; Gibb, Bruce C.","Binding properties and supramolecular polymerization of a water-soluble resorcin[4]arene","Organic Chemistry Frontiers","2019","6","8","1236","","10.1039/C9QO00182D","","","1.54184","CuKα","","0.1896","0.1646","","","0.4164","0.4366","","","","","","2.916","","","","has coordinates,has disorder","279649","2022-11-30","18:17:27",""
"1554768","9.9983","0.0002","16.3521","0.0004","19.4651","0.0005","102.163","0.001","90.869","0.001","105.091","0.001","2995.41","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C6.21 H2.28 Cl0.48 N0.07 O0.28 S0 -","- C6.2069 H2.27586 Cl0.482759 N0.0689655 O0.275862 -","- C180 H66 Cl14 N2 O8 -","29","14.5","","Zhang, Hao; Su, Jie; Pan, Changwang; Lu, Xing; Gan, Liangbing","Synthesis of an open-cage fullerene-based unidirectional H-bonding network and its coordination with titanium","Organic Chemistry Frontiers","2019","6","9","1397","","10.1039/C9QO00188C","","","0.6525","synchrotron","","0.0567","0.0545","","","0.1567","0.1595","","","","","","1.104","","","","has coordinates,has disorder","238110","2020-10-21","18:00:00",""
"1554769","10.4701","0.0003","25.097","0.0011","16.2566","0.0006","90","","91.218","0.003","90","","4270.8","0.3","179.98","0.11","179.98","0.11","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C143 H54 N2 O10 S2 -","- C143 H54 N2 O10 S2 -","- C286 H108 N4 O20 S4 -","2","0.5","","Zhang, Hao; Su, Jie; Pan, Changwang; Lu, Xing; Gan, Liangbing","Synthesis of an open-cage fullerene-based unidirectional H-bonding network and its coordination with titanium","Organic Chemistry Frontiers","2019","6","9","1397","","10.1039/C9QO00188C","","","0.71073","MoKα","","0.0873","0.0613","","","0.1482","0.1617","","","","","","1.001","","","","has coordinates,has disorder","238110","2020-10-21","18:00:00",""
"1554770","14.4203","0.0002","27.3088","0.0004","10.3569","0.0001","90","","94.182","0.001","90","","4067.7","0.09","180","0.1","180","0.1","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C70 H22.75 N O4.88 S2 -","- C70 H22.734 N O4.867 S2 -","- C280 H90.936 N4 O19.468 S8 -","4","1","","Zhang, Hao; Su, Jie; Pan, Changwang; Lu, Xing; Gan, Liangbing","Synthesis of an open-cage fullerene-based unidirectional H-bonding network and its coordination with titanium","Organic Chemistry Frontiers","2019","6","9","1397","","10.1039/C9QO00188C","","x-ray","0.71073","MoKα","","0.0451","0.0433","","","0.1187","0.1202","","","","","","1.026","","","","has coordinates","238110","2020-10-21","18:00:00",""
"1554771","10.4366","0.0001","16.3952","0.0003","16.824","0.0003","110.869","0.001","99.019","0.001","100.619","0.001","2565.14","0.08","180","0.1","180","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C81 H42.7 N O5.85 S2 -","- C81 H42.7 N O5.85 S2 -","- C162 H85.4 N2 O11.7 S4 -","2","1","","Zhang, Hao; Su, Jie; Pan, Changwang; Lu, Xing; Gan, Liangbing","Synthesis of an open-cage fullerene-based unidirectional H-bonding network and its coordination with titanium","Organic Chemistry Frontiers","2019","6","9","1397","","10.1039/C9QO00188C","","x-ray","0.71073","MoKα","","0.0856","0.0773","","","0.1924","0.197","","","","","","1.01","","","","has coordinates,has disorder","238110","2020-10-21","18:00:00",""
"1554772","10.4595","0.0004","25.0584","0.001","16.2556","0.0007","90","","91.316","0.004","90","","4259.4","0.3","179.99","0.1","179.99","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C143 H57.4 N2 O11.7 S2 -","- C143 H57.404 N2 O11.702 S2 -","- C286 H114.808 N4 O23.404 S4 -","2","0.5","","Zhang, Hao; Su, Jie; Pan, Changwang; Lu, Xing; Gan, Liangbing","Synthesis of an open-cage fullerene-based unidirectional H-bonding network and its coordination with titanium","Organic Chemistry Frontiers","2019","6","9","1397","","10.1039/C9QO00188C","","x-ray","0.71073","MoKα","","0.0924","0.0681","","","0.1553","0.1679","","","","","","1.027","","","","has coordinates","238110","2020-10-21","18:00:00",""
"1554775","13.3462","0.0004","10.2259","0.0003","12.0633","0.0004","90","","96.466","0.001","90","","1635.89","0.09","161","2","161","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H20 N2 Se -","- C19 H20 N2 Se -","- C76 H80 N8 Se4 -","4","1","","Guo, Tao; Wei, Xu-Ning; Liu, Yu; Zhang, Pan-Ke; Zhao, Yun-Hui","Oxidative dual C‒H selenation of imidazoheterocycles with ethers or alkanes using selenium powder via a radical pathway","Organic Chemistry Frontiers","2019","6","9","1414","","10.1039/C9QO00198K","","","1.54178","cukα","","0.0273","0.0261","","","0.0699","0.0712","","","","","","1.028","","","","has coordinates","238113","2020-10-21","18:00:00",""
"1554777","8.4621","0.0005","19.7458","0.001","21.2129","0.001","90","","90","","90","","3544.5","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H18 N O3 P -","- C21 H18 N O3 P -","- C168 H144 N8 O24 P8 -","8","2","","Bard, Jeremy P.; Deng, Chun-Lin; Richardson, Hannah C.; Odulio, Jacob M.; Barker, Joshua E.; Zakharov, Lev N.; Cheong, Paul H.-Y.; Johnson, Darren W.; Haley, Michael M.","Synthesis, photophysical properties, and self-dimerization studies of 2-λ5-phosphaquinolin-2-ones","Organic Chemistry Frontiers","2019","6","8","1257","","10.1039/C9QO00199A","","","1.54178","CuKα","","0.0849","0.0738","","","0.1871","0.1949","","","","","","1.066","","","","has coordinates","238115","2020-10-21","18:00:00",""
"1554778","18.5757","0.0004","6.176","0.0002","18.9148","0.0005","90","","98.809","0.002","90","","2144.38","0.1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H23 N2 O2 P -","- C25 H23 N2 O2 P -","- C100 H92 N8 O8 P4 -","4","1","","Bard, Jeremy P.; Deng, Chun-Lin; Richardson, Hannah C.; Odulio, Jacob M.; Barker, Joshua E.; Zakharov, Lev N.; Cheong, Paul H.-Y.; Johnson, Darren W.; Haley, Michael M.","Synthesis, photophysical properties, and self-dimerization studies of 2-λ5-phosphaquinolin-2-ones","Organic Chemistry Frontiers","2019","6","8","1257","","10.1039/C9QO00199A","","","1.54178","CuKα","","0.0564","0.0408","","","0.0999","0.1093","","","","","","1.022","","","","has coordinates","238115","2020-10-21","18:00:00",""
"1554779","29.394","0.003","6.3419","0.0005","28.119","0.003","90","","121.188","0.004","90","","4484.2","0.8","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22.5 H14.5 Cl1.5 F3 N2 O2 P -","- C22.5 H14 Cl1.5 F3 N2 O2 P -","- C180 H112 Cl12 F24 N16 O16 P8 -","8","1","","Bard, Jeremy P.; Deng, Chun-Lin; Richardson, Hannah C.; Odulio, Jacob M.; Barker, Joshua E.; Zakharov, Lev N.; Cheong, Paul H.-Y.; Johnson, Darren W.; Haley, Michael M.","Synthesis, photophysical properties, and self-dimerization studies of 2-λ5-phosphaquinolin-2-ones","Organic Chemistry Frontiers","2019","6","8","1257","","10.1039/C9QO00199A","","","1.54178","CuKα","","0.1045","0.0849","","","0.2236","0.2386","","","","","","1.086","","","","has coordinates","238115","2020-10-21","18:00:00",""
"1554780","24.331","0.004","10.2408","0.0018","14.54","0.003","90","","102.686","0.003","90","","3534.5","1.1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H15 N2 O2 P -","- C21 H15 N2 O2 P -","- C168 H120 N16 O16 P8 -","8","1","","Bard, Jeremy P.; Deng, Chun-Lin; Richardson, Hannah C.; Odulio, Jacob M.; Barker, Joshua E.; Zakharov, Lev N.; Cheong, Paul H.-Y.; Johnson, Darren W.; Haley, Michael M.","Synthesis, photophysical properties, and self-dimerization studies of 2-λ5-phosphaquinolin-2-ones","Organic Chemistry Frontiers","2019","6","8","1257","","10.1039/C9QO00199A","","","0.71073","MoKα","","0.0568","0.0369","","","0.0955","0.1104","","","","","","1.049","","","","has coordinates","238115","2020-10-21","18:00:00",""
"1554781","26.4131","0.0008","9.7872","0.0003","14.9148","0.0005","90","","115.7","0.001","90","","3474.22","0.19","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H15 N2 O2 P -","- C21 H15 N2 O2 P -","- C168 H120 N16 O16 P8 -","8","1","","Bard, Jeremy P.; Deng, Chun-Lin; Richardson, Hannah C.; Odulio, Jacob M.; Barker, Joshua E.; Zakharov, Lev N.; Cheong, Paul H.-Y.; Johnson, Darren W.; Haley, Michael M.","Synthesis, photophysical properties, and self-dimerization studies of 2-λ5-phosphaquinolin-2-ones","Organic Chemistry Frontiers","2019","6","8","1257","","10.1039/C9QO00199A","","","1.54178","CuKα","","0.0385","0.0346","","","0.093","0.0967","","","","","","1.028","","","","has coordinates","238115","2020-10-21","18:00:00",""
"1554784","14.1538","0.0012","10.7714","0.0008","20.0319","0.0019","90","","90","","90","","3054","0.4","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H18 N2 O2 S2 -","- C13 H18 N2 O2 S2 -","- C104 H144 N16 O16 S16 -","8","1","","Hoffmann, Kerstin; Guentner, Manuel; Mayer, Peter; Dube, Henry","Symmetric and nonsymmetric bis-hemithioindigos ‒ precise visible light controlled shape-shifters","Organic Chemistry Frontiers","2019","6","8","1244","","10.1039/C9QO00202B","","","0.71073","MoKα","","0.1567","0.0652","","","0.124","0.1493","","","","","","0.927","","","","has coordinates","238118","2020-10-21","18:00:00",""
"1554785","5.1535","0.0002","7.3073","0.0003","16.2864","0.0007","81.694","0.002","82.41","0.002","74.561","0.001","582.16","0.04","109","2","109","2","","","","","","","","4","P -1","-P 1","2","KH-195","","","- C11 H12 O4 S2 -","- C11 H12 O4 S2 -","- C22 H24 O8 S4 -","2","1","","Hoffmann, Kerstin; Guentner, Manuel; Mayer, Peter; Dube, Henry","Symmetric and nonsymmetric bis-hemithioindigos ‒ precise visible light controlled shape-shifters","Organic Chemistry Frontiers","2019","6","8","1244","","10.1039/C9QO00202B","","","0.71073","MoKα","","0.0459","0.0367","","","0.0941","0.0995","","","","","","1.076","","","","has coordinates","238118","2020-10-21","18:00:00",""
"1554786","19.6986","0.0013","10.9502","0.0008","16.5805","0.0011","90","","122.988","0.0017","90","","2999.9","0.4","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C36 H38 O2 S2 -","- C36 H38 O2 S2 -","- C144 H152 O8 S8 -","4","1","","Hoffmann, Kerstin; Guentner, Manuel; Mayer, Peter; Dube, Henry","Symmetric and nonsymmetric bis-hemithioindigos ‒ precise visible light controlled shape-shifters","Organic Chemistry Frontiers","2019","6","8","1244","","10.1039/C9QO00202B","","","0.71073","MoKα","","0.0457","0.0369","","","0.088","0.0921","","","","","","1.043","","","","has coordinates,has disorder","238118","2020-10-21","18:00:00",""
"1554787","9.4599","0.0007","10.4995","0.0008","17.9405","0.0013","82.254","0.002","86.522","0.003","88.292","0.002","1762","0.2","103","2","103","2","","","","","","","","4","P -1","-P 1","2","KH-11","","","- C40 H46 O2 S2 -","- C40 H46 O2 S2 -","- C80 H92 O4 S4 -","2","1","","Hoffmann, Kerstin; Guentner, Manuel; Mayer, Peter; Dube, Henry","Symmetric and nonsymmetric bis-hemithioindigos ‒ precise visible light controlled shape-shifters","Organic Chemistry Frontiers","2019","6","8","1244","","10.1039/C9QO00202B","","","0.71073","MoKα","","0.066","0.0501","","","0.1333","0.1452","","","","","","1.045","","","","has coordinates,has disorder","238118","2020-10-21","18:00:00",""
"1554788","11.3446","0.0008","17.747","0.0013","17.3945","0.0012","90","","97.039","0.002","90","","3475.7","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C41 H48 O2 S2 -","- C41 H48 O2 S2 -","- C164 H192 O8 S8 -","4","1","","Hoffmann, Kerstin; Guentner, Manuel; Mayer, Peter; Dube, Henry","Symmetric and nonsymmetric bis-hemithioindigos ‒ precise visible light controlled shape-shifters","Organic Chemistry Frontiers","2019","6","8","1244","","10.1039/C9QO00202B","","","0.71073","MoKα","","0.0798","0.0463","","","0.0976","0.1098","","","","","","1.028","","","","has coordinates","238118","2020-10-21","18:00:00",""
"1554789","10.5966","0.0004","11.0075","0.0004","13.0168","0.0005","90","","103.286","0.0013","90","","1477.67","0.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 N2 O2 S2 -","- C13 H18 N2 O2 S2 -","- C52 H72 N8 O8 S8 -","4","1","","Hoffmann, Kerstin; Guentner, Manuel; Mayer, Peter; Dube, Henry","Symmetric and nonsymmetric bis-hemithioindigos ‒ precise visible light controlled shape-shifters","Organic Chemistry Frontiers","2019","6","8","1244","","10.1039/C9QO00202B","","","0.71073","MoKα","","0.0505","0.0407","","","0.0965","0.1012","","","","","","1.101","","","","has coordinates","238118","2020-10-21","18:00:00",""
"1554790","14.4032","0.0007","9.233","0.0005","24.7181","0.0015","90","","93.6338","0.0015","90","","3280.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H40 O2 S2 -","- C37 H40 O2 S2 -","- C148 H160 O8 S8 -","4","1","","Hoffmann, Kerstin; Guentner, Manuel; Mayer, Peter; Dube, Henry","Symmetric and nonsymmetric bis-hemithioindigos ‒ precise visible light controlled shape-shifters","Organic Chemistry Frontiers","2019","6","8","1244","","10.1039/C9QO00202B","","","0.71073","MoKα","","0.0599","0.0426","","","0.1038","0.1143","","","","","","1.051","","","","has coordinates","238118","2020-10-21","18:00:00",""
"1554792","12.234","0.0011","10.9831","0.0011","14.6454","0.0014","90","","111.492","0.003","90","","1831","0.3","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H12 F6 Se -","- C24 H12 F6 Se -","- C96 H48 F24 Se4 -","4","1","","Shi, Xinzhe; Mao, Shuxin; Roisnel, Thierry; Doucet, Henri; Soulé, Jean-François","Palladium-catalyzed successive C‒H bond arylations and annulations toward the π-extension of selenophene-containing aromatic skeletons","Organic Chemistry Frontiers","2019","6","14","2398","","10.1039/C9QO00218A","","x-ray","0.71073","MoKα","","0.0331","0.0256","","","0.0625","0.0672","","","","","","1.048","","","","has coordinates","238120","2020-10-21","18:00:00",""
"1554795","11.6434","0.0005","14.186","0.0005","17.6525","0.0006","90","","90","","90","","2915.72","0.19","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H23 Br F3 N2 O3 -","- C36 H23 Br F3 N2 O3 -","- C144 H92 Br4 F12 N8 O12 -","4","1","","Li, Boyu; Gao, Fengyun; Feng, Xing; Sun, Mengmeng; Guo, Yifei; Wen, Dongwa; Deng, Yabo; Huang, Jinqi; Wang, Kairong; Yan, Wenjin","Highly efficient enantioselective synthesis of bispiro[benzofuran-oxindole-pyrrolidine]s through organocatalytic cycloaddition","Organic Chemistry Frontiers","2019","6","10","1567","","10.1039/C9QO00241C","","","1.54178","CuKα","","0.0321","0.0315","","","0.0782","0.0786","","","","","","1.001","","","","has coordinates","238123","2020-10-21","18:00:00",""
"1554799","9.8327","0.0003","16.984","0.0006","16.2007","0.0005","90","","101.138","0.001","90","","2654.54","0.15","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C27 H40 O6 -","- C27 H40 O6 -","- C108 H160 O24 -","4","2","","Zhang, Na; Shi, Zhengyi; Guo, Yi; Xie, Shuangshuang; Qiao, Yuben; Li, Xiao-Nian; Xue, Yongbo; Luo, Zengwei; Zhu, Hucheng; Chen, Chunmei; Hu, Linzhen; Zhang, Yonghui","The absolute configurations of hyperilongenols A‒C: rare 12,13-seco-spirocyclic polycyclic polyprenylated acylphloroglucinols with enolizable β,β′-tricarbonyl systems from Hypericum longistylum Oliv.","Organic Chemistry Frontiers","2019","6","9","1491","","10.1039/C9QO00245F","","","1.54178","CuKα","","0.0628","0.0615","","","0.1752","0.1773","","","","","","1.031","","","","has coordinates,has disorder","238126","2020-10-21","18:00:00",""
"1554800","12.0011","0.0003","13.3921","0.0003","17.7454","0.0004","90","","90","","90","","2852.04","0.12","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C29 H44 O6 -","- C29 H44 O6 -","- C116 H176 O24 -","4","1","","Zhang, Na; Shi, Zhengyi; Guo, Yi; Xie, Shuangshuang; Qiao, Yuben; Li, Xiao-Nian; Xue, Yongbo; Luo, Zengwei; Zhu, Hucheng; Chen, Chunmei; Hu, Linzhen; Zhang, Yonghui","The absolute configurations of hyperilongenols A‒C: rare 12,13-seco-spirocyclic polycyclic polyprenylated acylphloroglucinols with enolizable β,β′-tricarbonyl systems from Hypericum longistylum Oliv.","Organic Chemistry Frontiers","2019","6","9","1491","","10.1039/C9QO00245F","","","1.54178","CuKα","","0.0316","0.0316","","","0.0813","0.0814","","","","","","1.072","","","","has coordinates","238126","2020-10-21","18:00:00",""
"1554801","9.6691","0.0001","16.4235","0.0001","15.94","0.0001","90","","101.09","","90","","2484.01","0.03","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C26 H38 O6 -","- C26 H38 O6 -","- C104 H152 O24 -","4","2","","Zhang, Na; Shi, Zhengyi; Guo, Yi; Xie, Shuangshuang; Qiao, Yuben; Li, Xiao-Nian; Xue, Yongbo; Luo, Zengwei; Zhu, Hucheng; Chen, Chunmei; Hu, Linzhen; Zhang, Yonghui","The absolute configurations of hyperilongenols A‒C: rare 12,13-seco-spirocyclic polycyclic polyprenylated acylphloroglucinols with enolizable β,β′-tricarbonyl systems from Hypericum longistylum Oliv.","Organic Chemistry Frontiers","2019","6","9","1491","","10.1039/C9QO00245F","","","1.54178","CuKα","","0.0395","0.0391","","","0.1027","0.103","","","","","","1.035","","","","has coordinates","238126","2020-10-21","18:00:00",""
"1554805","12.983","0.003","13.401","0.003","29.22","0.006","81.31","0.03","77.62","0.03","61.97","0.03","4376","2","301","2","301","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C162 H174 Au4 Cl16 O8 P4 -","- C162 H174 Au4 Cl16 O8 P4 -","- C162 H174 Au4 Cl16 O8 P4 -","1","0.5","","Hau, Franky Ka-Wah; Cheung, Kai-Leung; Zhu, Nianyong; Yam, Vivian Wing-Wah","Calixarene-based alkynyl-bridged gold(i) isocyanide and phosphine complexes as building motifs for the construction of chemosensors and supramolecular architectures","Organic Chemistry Frontiers","2019","6","8","1205","","10.1039/C9QO00258H","","x-ray","0.71073","MoKα","","0.1285","0.0751","","","0.2182","0.2492","","","","","","0.97","","","","has coordinates","238128","2020-10-21","18:00:00",""
"1554807","10.4979","0.0007","10.7112","0.0007","10.8365","0.0007","60.7986","0.0016","76.2796","0.0017","71.3801","0.0017","1003.08","0.12","200","2","200","2","","","","","","","","4","P -1","-P 1","2","5a in manuscript","","","- C27 H23 N O -","- C27 H23 N O -","- C54 H46 N2 O2 -","2","1","","Lustosa, Danilo M.; Cieslik, Patrick; Hartmann, Deborah; Bruckhoff, Tim; Rudolph, Matthias; Rominger, Frank; Hashmi, A. Stephen K.","Direct access to benzo[b]fluorenes via a gold-catalysed A3-coupling strategy","Organic Chemistry Frontiers","2019","6","10","1655","","10.1039/C9QO00260J","","","0.71073","MoKα","","0.0956","0.0551","","","0.1259","0.1418","","","","","","1.023","","","","has coordinates","238130","2020-10-21","18:00:00",""
"1554808","6.7344","0.0004","18.9552","0.0012","15.1244","0.0008","90","","90.856","0.004","90","","1930.4","0.2","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","6a in manuscript","","","- C27 H23 N O -","- C27 H23 N O -","- C108 H92 N4 O4 -","4","2","","Lustosa, Danilo M.; Cieslik, Patrick; Hartmann, Deborah; Bruckhoff, Tim; Rudolph, Matthias; Rominger, Frank; Hashmi, A. Stephen K.","Direct access to benzo[b]fluorenes via a gold-catalysed A3-coupling strategy","Organic Chemistry Frontiers","2019","6","10","1655","","10.1039/C9QO00260J","","","1.54178","CuKα","","0.1004","0.0799","","","0.2324","0.2432","","","","","","1.578","","","","has coordinates","238130","2020-10-21","18:00:00",""
"1554811","9.7212","0.0001","10.3208","0.0001","28.5171","0.0003","90","","90","","90","","2861.14","0.05","100","0.1","100","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H30 N2 O7 -","- C34 H30 N2 O7 -","- C136 H120 N8 O28 -","4","1","","Liu, Xiong-Li; Zuo, Xiong; Wang, Jun-Xin; Chang, Shun-qin; Wei, Qi-Di; Zhou, Ying","A bifunctional pyrazolone‒chromone synthon directed organocatalytic double Michael cascade reaction: forging five stereocenters in structurally diverse hexahydroxanthones","Organic Chemistry Frontiers","2019","6","9","1485","","10.1039/C9QO00265K","","x-ray","1.54184","CuKα","","0.0327","0.0323","","","0.081","0.0813","","","","","","1.084","","","","has coordinates","238133","2020-10-21","18:00:00",""
"1554812","11.7466","0.0001","12.2636","0.0002","22.7319","0.0002","90","","93.091","0.001","90","","3269.89","0.07","100","0.1","100","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C36 H32 F N3 O7 -","- C36 H32 F N3 O7 -","- C144 H128 F4 N12 O28 -","4","2","","Liu, Xiong-Li; Zuo, Xiong; Wang, Jun-Xin; Chang, Shun-qin; Wei, Qi-Di; Zhou, Ying","A bifunctional pyrazolone‒chromone synthon directed organocatalytic double Michael cascade reaction: forging five stereocenters in structurally diverse hexahydroxanthones","Organic Chemistry Frontiers","2019","6","9","1485","","10.1039/C9QO00265K","","x-ray","1.54184","CuKα","","0.0353","0.0345","","","0.0958","0.0964","","","","","","1.035","","","","has coordinates","238133","2020-10-21","18:00:00",""
"1554816","6.2353","0.0004","7.7873","0.0004","17.3098","0.001","90","","90.759","0.003","90","","840.42","0.08","170","2","169.99","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H16 Br F3 O2 -","- C17 H16 Br F3 O2 -","- C34 H32 Br2 F6 O4 -","2","1","","Chen, Daoqian; Lu, Long; Shen, Qilong","[Ag(bpy)(PPhtBu2)(OCF3)]: a stable nucleophilic reagent for chemoselective and stereospecific trifluoromethoxylation of secondary alkyl nosylates","Organic Chemistry Frontiers","2019","6","11","1801","","10.1039/C9QO00278B","","","1.34139","GaKα","","0.0375","0.0343","","","0.0841","0.0874","","","","","","1.064","","","","has coordinates","238138","2020-10-21","18:00:00",""
"1554817","10.6202","0.0004","6.377","0.0002","16.3385","0.0006","90","","98.252","0.001","90","","1095.07","0.07","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H21 N O7 S -","- C23 H21 N O7 S -","- C46 H42 N2 O14 S2 -","2","1","","Chen, Daoqian; Lu, Long; Shen, Qilong","[Ag(bpy)(PPhtBu2)(OCF3)]: a stable nucleophilic reagent for chemoselective and stereospecific trifluoromethoxylation of secondary alkyl nosylates","Organic Chemistry Frontiers","2019","6","11","1801","","10.1039/C9QO00278B","","","0.71073","MoKα","","0.054","0.0385","","","0.0991","0.1128","","","","","","1.041","","","","has coordinates","238138","2020-10-21","18:00:00",""
"1554818","6.4981","0.0003","15.2542","0.0006","17.146","0.0006","90","","90","","90","","1699.57","0.12","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H17 F3 O3 -","- C18 H17 F3 O3 -","- C72 H68 F12 O12 -","4","1","","Chen, Daoqian; Lu, Long; Shen, Qilong","[Ag(bpy)(PPhtBu2)(OCF3)]: a stable nucleophilic reagent for chemoselective and stereospecific trifluoromethoxylation of secondary alkyl nosylates","Organic Chemistry Frontiers","2019","6","11","1801","","10.1039/C9QO00278B","","","1.54178","CuKα","","0.0469","0.0445","","","0.1257","0.1298","","","","","","1.048","","","","has coordinates","238138","2020-10-21","18:00:00",""
"1554819","15.277","0.0004","8.0788","0.0002","21.7171","0.0005","90","","98.481","0.001","90","","2651.01","0.11","170","2","169.96","","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C24 H31 Ag F6 N2 P2 -","- C24 H31 Ag F6 N2 P2 -","- C96 H124 Ag4 F24 N8 P8 -","4","2","","Chen, Daoqian; Lu, Long; Shen, Qilong","[Ag(bpy)(PPhtBu2)(OCF3)]: a stable nucleophilic reagent for chemoselective and stereospecific trifluoromethoxylation of secondary alkyl nosylates","Organic Chemistry Frontiers","2019","6","11","1801","","10.1039/C9QO00278B","","","1.34139","GaKα","","0.0435","0.0405","","","0.0968","0.0997","","","","","","1.036","","","","has coordinates","238138","2020-10-21","18:00:00",""
"1554820","12.7111","0.0004","17.36","0.0006","15.7081","0.0005","90","","105.588","0.001","90","","3338.73","0.19","170","2","170.02","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H41 Ag F6 N4 P2 -","- C31 H41 Ag F6 N4 P2 -","- C124 H164 Ag4 F24 N16 P8 -","4","1","","Chen, Daoqian; Lu, Long; Shen, Qilong","[Ag(bpy)(PPhtBu2)(OCF3)]: a stable nucleophilic reagent for chemoselective and stereospecific trifluoromethoxylation of secondary alkyl nosylates","Organic Chemistry Frontiers","2019","6","11","1801","","10.1039/C9QO00278B","","","1.34139","GaKα","","0.0437","0.0429","","","0.1263","0.1278","","","","","","1.108","","","","has coordinates","238138","2020-10-21","18:00:00",""
"1554821","11.3702","0.0003","12.6386","0.0003","17.83","0.0005","90","","103.361","0.001","90","","2492.88","0.11","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H31 Ag F3 N2 O P -","- C25 H31 Ag F3 N2 O P -","- C100 H124 Ag4 F12 N8 O4 P4 -","4","1","","Chen, Daoqian; Lu, Long; Shen, Qilong","[Ag(bpy)(PPhtBu2)(OCF3)]: a stable nucleophilic reagent for chemoselective and stereospecific trifluoromethoxylation of secondary alkyl nosylates","Organic Chemistry Frontiers","2019","6","11","1801","","10.1039/C9QO00278B","","","0.71073","MoKα","","0.0284","0.026","","","0.0875","0.0904","","","","","","1.011","","","","has coordinates","238138","2020-10-21","18:00:00",""
"1554823","8.061","0.0002","10.8588","0.0002","27.7356","0.0006","90","","90","","90","","2427.77","0.09","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C27 H40 O4 -","- C27 H40 O4 -","- C108 H160 O16 -","4","1","","Xu, Hou-Chao; Hu, Kun; Shi, Xiao-Huo; Tang, Jian-Wei; Li, Xiao-Nian; Sun, Han-Dong; Puno, Pema-Tenzin","Synergistic use of NMR computation and quantitative interproton distance analysis in the structural determination of neokadcoccitane A, a rearranged triterpenoid featuring an aromatic ring D from Kadsura coccinea","Organic Chemistry Frontiers","2019","6","10","1619","","10.1039/C9QO00281B","","","1.54178","CuKα","","0.036","0.0358","","","0.0981","0.0984","","","","","","1.085","","","","has coordinates","238140","2020-10-21","18:00:00",""
"1554825","5.4882","0.0007","11.1825","0.0015","11.6413","0.0016","62.292","0.014","80.059","0.011","76.727","0.011","613.82","0.16","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H13 N3 -","- C15 H13 N3 -","- C30 H26 N6 -","2","1","","Farinone, Marco; Cybińska, Joanna; Pawlicki, Miłosz","A controlled blue-shift in meso-nitrogen aryl fused DIPY and BODIPY skeletons","Organic Chemistry Frontiers","2019","6","16","2825","","10.1039/C9QO00294D","","","1.54184","CuKα","","0.1177","0.0956","","","0.2368","0.2677","","","","","","1.009","","","","has coordinates","238142","2020-10-21","18:00:00",""
"1554826","15.105","0.0005","12.8664","0.0004","15.5822","0.0005","90","","91.952","0.003","90","","3026.6","0.17","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H17 N3 O2 -","- C17 H17 N3 O2 -","- C136 H136 N24 O16 -","8","1","","Farinone, Marco; Cybińska, Joanna; Pawlicki, Miłosz","A controlled blue-shift in meso-nitrogen aryl fused DIPY and BODIPY skeletons","Organic Chemistry Frontiers","2019","6","16","2825","","10.1039/C9QO00294D","","","0.71073","MoKα","","0.1063","0.0658","","","0.1466","0.1757","","","","","","1.041","","","","has coordinates","238142","2020-10-21","18:00:00",""
"1554827","7.1859","0.0004","12.0427","0.0007","12.0895","0.0009","93.791","0.005","100.927","0.005","98.538","0.005","1011.05","0.11","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C19 H17 B F2 N4 O2 -","- C19 H17 B F2 N4 O2 -","- C38 H34 B2 F4 N8 O4 -","2","1","","Farinone, Marco; Cybińska, Joanna; Pawlicki, Miłosz","A controlled blue-shift in meso-nitrogen aryl fused DIPY and BODIPY skeletons","Organic Chemistry Frontiers","2019","6","16","2825","","10.1039/C9QO00294D","","x-ray","0.71073","MoKα","","0.0683","0.0479","","","0.1168","0.1299","","","","","","1.018","","","","has coordinates","238142","2020-10-21","18:00:00",""
"1554828","10.668","0.0014","24.498","0.004","11.286","0.003","90","","93.034","0.012","90","","2945.4","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 N3 O2.5 -","- C17 H16 N3 O2.5 -","- C136 H128 N24 O20 -","8","2","","Farinone, Marco; Cybińska, Joanna; Pawlicki, Miłosz","A controlled blue-shift in meso-nitrogen aryl fused DIPY and BODIPY skeletons","Organic Chemistry Frontiers","2019","6","16","2825","","10.1039/C9QO00294D","","","0.71073","MoKα","","0.2527","0.0753","","","0.0943","0.1374","","","","","","0.799","","","","has coordinates","238142","2020-10-21","18:00:00",""
"1554829","11.1306","0.0003","11.7622","0.0003","24.0194","0.0007","90","","91.217","0.002","90","","3143.92","0.15","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17.14 H14.5 B F2 N3 O2 -","- C17 H16 B F2 N3 O2 -","- C136 H128 B8 F16 N24 O16 -","8","2","","Farinone, Marco; Cybińska, Joanna; Pawlicki, Miłosz","A controlled blue-shift in meso-nitrogen aryl fused DIPY and BODIPY skeletons","Organic Chemistry Frontiers","2019","6","16","2825","","10.1039/C9QO00294D","","","0.71073","MoKα","","0.0798","0.0599","","","0.1524","0.173","","","","","","1.04","","","","has coordinates,has disorder","238142","2020-10-21","18:00:00",""
"1554836","9.5782","0.0006","11.765","0.0004","20.2153","0.0009","90","","90","","90","","2278.01","0.19","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H26 N4 O5 -","- C22 H26 N4 O5 -","- C88 H104 N16 O20 -","4","1","","Dai, Chuan; Ma, Jun; Li, Min; Wu, Wen; Xia, Xuefeng; Zhang, Jinqiang","Diversity-oriented submonomer synthesis of azapeptides mediated by the Mitsunobu reaction","Organic Chemistry Frontiers","2019","6","14","2529","","10.1039/C9QO00296K","","","0.71073","MoKα","","0.0883","0.0601","","","0.1385","0.1634","","","","","","1.072","","","","has coordinates","238144","2020-10-21","18:00:00",""
"1554843","10.7226","0.0003","12.3939","0.0003","15.6108","0.0004","90","","92.991","0.003","90","","2071.77","0.09","123","40","123","40","","","","","","","","7","C 1 c 1","C -2yc","9","1a","","","- C16 H23 Cl F6 N3 O2 P -","- C16 H23 Cl F6 N3 O2 P -","- C64 H92 Cl4 F24 N12 O8 P4 -","4","1","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.0509","0.0434","","","0.1061","0.1107","","","","","","1.038","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554844","11.8795","0.0005","14.5176","0.0005","12.6593","0.0006","90","","102.138","0.004","90","","2134.44","0.16","149","2","149","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H23 Cl2 F6 N2 O2 P -","- C17 H23 Cl2 F6 N2 O2 P -","- C68 H92 Cl8 F24 N8 O8 P4 -","4","1","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.0571","0.04","","","0.0888","0.0979","","","","","","1.035","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554845","36.485","0.007","10.158","0.002","16.856","0.003","90","","92.44","0.03","90","","6241","2","200","","200","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H41 F6 N4 O2 P -","- C28 H41 F6 N4 O2 P -","- C224 H328 F48 N32 O16 P8 -","8","1","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.0861","0.0524","","","0.1225","0.1496","","","","","","1.096","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554846","24.915","0.002","8.8562","0.0007","19.8464","0.0018","90","","105.666","0.009","90","","4216.5","0.6","150","0.1","150","0.1","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C34 H49 F12 N7 O4 P2 -","- C34 H49 F12 N7 O4 P2 -","- C136 H196 F48 N28 O16 P8 -","4","0.5","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.138","0.0803","","","0.1669","0.196","","","","","","1.048","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554847","10.7516","0.0004","12.0558","0.0006","14.8348","0.0006","107.62","0.004","93.413","0.003","109.731","0.004","1696.8","0.14","150","0.14","150","0.14","","","","","","","","7","P -1","-P 1","2","6c","","","- C26 H39.5 F9 N4.5 O5 P S -","- C26 H39.5 F9 N4.5 O5 P S -","- C52 H79 F18 N9 O10 P2 S2 -","2","1","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.0828","0.0612","","","0.1572","0.1736","","","","","","1.04","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554848","7.59057","0.00019","26.3895","0.0007","12.488","0.0003","90","","107.133","0.003","90","","2390.48","0.11","149.95","0.1","149.95","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H29 Cl F6 N3 O2 P -","- C19 H29 Cl F6 N3 O2 P -","- C76 H116 Cl4 F24 N12 O8 P4 -","4","1","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.0593","0.0449","","","0.0993","0.1058","","","","","","1.064","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554849","12.3903","0.001","16.1931","0.001","13.6174","0.0011","90","","113.783","0.01","90","","2500.1","0.4","149.95","0.1","149.95","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","9b","","","- C21 H32 F6 N4 O2 P -","- C21 H32 F6 N4 O2 P -","- C84 H128 F24 N16 O8 P4 -","4","1","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.0871","0.058","","","0.131","0.1473","","","","","","1.017","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554850","10.5891","0.0002","16.2883","0.0004","13.903","0.0003","90","","102.985","0.002","90","","2336.65","0.09","150","0.14","150","0.14","","","","","","","","6","P 1 21/n 1","-P 2yn","14","6a","","","- C16 H23 F12 N3 O2 P2 -","- C16 H23 F12 N3 O2 P2 -","- C64 H92 F48 N12 O8 P8 -","4","1","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.0846","0.053","","","0.1114","0.1245","","","","","","1.044","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554851","18.6093","0.0007","10.778","0.0003","15.4265","0.0006","90","","101.706","0.004","90","","3029.76","0.19","149","3","149","3","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H41 Cl2 F6 N2 O2 P -","- C26 H41 Cl2 F6 N2 O2 P -","- C104 H164 Cl8 F24 N8 O8 P4 -","4","1","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.0973","0.0544","","","0.1016","0.117","","","","","","1.01","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554852","9.5322","0.0004","18.6061","0.0007","21.1198","0.0011","83.275","0.004","88.086","0.004","80.993","0.003","3673.7","0.3","150","0.14","150","0.14","","","","","","","","7","P -1","-P 1","2","","","","- C30.33 H52.53 Cl2.12 F6 N3 O2.44 P -","- C30.323 H52.528 Cl2.118 F6 N3 O2.441 P -","- C121.292 H210.112 Cl8.472 F24 N12 O9.764 P4 -","4","2","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.1554","0.1108","","","0.2715","0.2951","","","","","","1.105","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554853","12.7678","0.0013","11.6389","0.001","36.278","0.003","90","","94.051","0.007","90","","5377.6","0.8","150","0.14","150","0.14","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H35 Cl F6 N3 O2 P -","- C22 H35 Cl F6 N3 O2 P -","- C176 H280 Cl8 F48 N24 O16 P8 -","8","2","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.2373","0.0847","","","0.1418","0.2095","","","","","","0.929","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554854","12.1931","0.0003","15.3991","0.0004","22.7102","0.0005","95.65","0.002","102.392","0.002","94.7722","0.0019","4120.61","0.18","149.95","0.1","149.95","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C33 H47.66 F12 N6.5 O4.08 P2 -","- C33 H47.659 F12 N6.5 O4.0795 P2 -","- C132 H190.636 F48 N26 O16.318 P8 -","4","2","","Devillard, Marc; Regnier, Vianney; Pecaut, Jacques; Martin, David","Stable dicationic dioxoliums and fate of their dioxolyl radicals","Organic Chemistry Frontiers","2019","6","18","3184","","10.1039/C9QO00298G","","x-ray","0.71073","MoKα","","0.0807","0.0581","","","0.1262","0.137","","","","","","1.02","","","","has coordinates,has disorder","238151","2020-10-21","18:00:00",""
"1554857","6.9512","0.0002","8.6039","0.0003","15.1128","0.0004","102.337","0.001","92.466","0.001","108.002","0.001","833.95","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H20 O3 S -","- C19 H20 O3 S -","- C38 H40 O6 S2 -","2","1","","He, Fu-Sheng; Wu, Youqian; Li, Xiaofang; Xia, Hongguang; Wu, Jie","Photoredox-catalyzed sulfonylation of alkenylcyclobutanols with the insertion of sulfur dioxide through semipinacol rearrangement","Organic Chemistry Frontiers","2019","6","11","1873","","10.1039/C9QO00300B","","","1.34138","GaKα","","0.044","0.0415","","","0.1121","0.1148","","","","","","1.048","","","","has coordinates","238154","2020-10-21","18:00:00",""
"1554859","6.0877","0.0011","10.8073","0.0014","26.052","0.004","90","","93.948","0.006","90","","1709.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H23 N O5 S -","- C17 H23 N O5 S -","- C68 H92 N4 O20 S4 -","4","1","","Xu, Dongyang; Wei, Hongbo; Zhen, Yanxia; Gao, Yu-Qi; Li, Ruoxin; Li, Xingzhou; He, Yupeng; Zhang, Zhong; Xie, Weiqing","Carboxylate phosphabetaine as a bifunctional organocatalyst for the intramolecular ring opening of oxetane","Organic Chemistry Frontiers","2019","6","10","1681","","10.1039/C9QO00304E","","","0.71073","","","0.0465","0.0383","","","0.0902","0.0943","","","","","","1.085","","","","has coordinates","238156","2020-10-21","18:00:00",""
"1554861","6.4968","0.0013","22.26","0.005","7.1909","0.0014","90","","116.2","0.03","90","","933.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H11 B0.75 O2.25 -","- C9 H11 B O3 -","- C36 H44 B4 O12 -","4","1","","Bhavanarushi, Sangepu; Xu, Yin; Khan, Imran; Luo, Zhibin; Liu, Bin; Xie, Jimin","Transition-metal-free borylation of propargylic alcohols: structurally variable synthesis in ionic liquid medium","Organic Chemistry Frontiers","2019","6","11","1895","","10.1039/C9QO00322C","","","0.71073","MoKα","","0.0449","0.0385","","","0.136","0.1423","","","","","","1.105","","","","has coordinates","238158","2020-10-21","18:00:00",""
"1554863","5.41","0.002","17.433","0.007","11.237","0.004","90","","93.29","0.007","90","","1058","0.7","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H7 F3 N2 O2 -","- C11 H7 F3 N2 O2 -","- C44 H28 F12 N8 O8 -","4","1","","Peng, Xiaofeng; Zhang, Xiaofei; Li, Shunyao; Lu, Yunfu; Lan, Lefu; Yang, Chunhao","Silver-mediated synthesis of novel 3-CF3/CN/phosphonate-substituted pyrazoles as pyrrolomycin analogues from 3-formylchromones and diazo compounds","Organic Chemistry Frontiers","2019","6","11","1775","","10.1039/C9QO00324J","","","0.71073","MoKα","","0.1046","0.0595","","","0.1375","0.1599","","","","","","1.019","","","","has coordinates","238160","2020-10-21","18:00:00",""
"1554865","12.2161","0.0005","12.5468","0.0005","16.7879","0.0007","90","","90","","90","","2573.13","0.18","273","2","273.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H22 N2 O9 S -","- C24 H22 N2 O9 S -","- C96 H88 N8 O36 S4 -","4","1","","Zhou, Qing; Chen, Bo; Huang, Xiao-Bing; Zeng, Ya-Li; Chu, Wen-Dao; He, Long; Liu, Quan-Zhong","Palladium-catalyzed diastereo- and enantioselective formal [3 + 2] cycloaddition of vinyl cyclopropanes with cyclic 1-azadienes","Organic Chemistry Frontiers","2019","6","11","1891","","10.1039/C9QO00325H","","","1.54178","CuKα","","0.072","0.0579","","","0.1392","0.1531","","","","","","1.088","","","","has coordinates","238162","2020-10-21","18:00:00",""
"1554866","10.3133","0.0004","11.2328","0.0004","19.0954","0.0008","90","","99.604","0.002","90","","2181.14","0.15","293","2","293.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 O6 -","- C24 H24 O6 -","- C96 H96 O24 -","4","1","","Zhou, Qing; Chen, Bo; Huang, Xiao-Bing; Zeng, Ya-Li; Chu, Wen-Dao; He, Long; Liu, Quan-Zhong","Palladium-catalyzed diastereo- and enantioselective formal [3 + 2] cycloaddition of vinyl cyclopropanes with cyclic 1-azadienes","Organic Chemistry Frontiers","2019","6","11","1891","","10.1039/C9QO00325H","","","1.54178","CuKα","","0.054","0.0499","","","0.1332","0.1372","","","","","","1.038","","","","has coordinates","238162","2020-10-21","18:00:00",""
"1554868","5.9309","0.0006","17.47","0.002","19.675","0.003","90","","90","","90","","2038.6","0.4","173","2","173","2","","","","","","","synthesis","5","P 21 21 21","P 2ac 2ab","19","4-spiropyrazolone","3-(4-chlorophenyl)-7-methoxy-3'-methyl-1'-phenyl-3H-spiro[benzofuran-2,4'-pyrazol]-5'(1'H)-one","","- C24 H19 Cl N2 O3 -","- C24 H19 Cl N2 O3 -","- C96 H76 Cl4 N8 O12 -","4","1","","Chu, Ming-Ming; Qi, Suo-Suo; Wang, Yi-Feng; Wang, Biao; Jiang, Zhen-Hui; Xu, Dan-Qian; Xu, Zhen-Yuan","Organocatalytic asymmetric [4 + 1] annulation of in situ generated ortho-quinomethanes with 4-halo pyrazolones: straightforward access to chiral spiro-benzofuran pyrazolones","Organic Chemistry Frontiers","2019","6","12","1977","","10.1039/C9QO00332K","","","0.71073","MoKα","","0.0663","0.0585","","","0.1544","0.1624","","","","","","1.085","","","","has coordinates","238164","2020-10-21","18:00:00",""
"1554870","9.3579","0.0019","12.566","0.003","29.371","0.006","90","","96.6","0.03","90","","3430.9","1.3","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 N2 O4 -","- C19 H18 N2 O4 -","- C152 H144 N16 O32 -","8","2","","Zhang, Wei; Zheng, Han-Liang; Liu, Yang; Yu, Ao; Yang, Chen; Li, Xin; Cheng, Jin-Pei","Catalyst-free amination of α-cyanoarylacetates enabled by single-electron transfer","Organic Chemistry Frontiers","2019","6","11","1900","","10.1039/C9QO00346K","","","0.71073","MoKα","","0.0772","0.0543","","","0.1222","0.1366","","","","","","1.053","","","","has coordinates","238166","2020-10-21","18:00:00",""
"1554872","7.807","0.0003","15.9924","0.0005","10.5193","0.0004","90","","109.003","0.004","90","","1241.79","0.08","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H29 N3 O4 -","- C28 H29 N3 O4 -","- C56 H58 N6 O8 -","2","1","","Zhang, Yan-Ping; You, Yong; Zhao, Jian-Qiang; Zhou, Xiao-Jian; Zhang, Xiao-Mei; Xu, Xiao-Ying; Yuan, Wei-Cheng","A AgOAc/quinine-derived aminophosphine complex as an efficient catalyst for diastereo- and enantioselective 1,3-dipolar cycloaddition of α,β-unsaturated 7-azaindoline amides and azomethine ylides","Organic Chemistry Frontiers","2019","6","11","1879","","10.1039/C9QO00347A","","x-ray","1.54184","CuKα","","0.0442","0.0395","","","0.1007","0.106","","","","","","1.042","","","","has coordinates","238168","2020-10-21","18:00:00",""
"1554874","8.0029","0.0001","15.3468","0.0003","17.8042","0.0003","90","","90","","90","","2186.69","0.06","299.44","0.1","299.44","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H30 O8 -","- C23 H30 O8 -","- C92 H120 O32 -","4","1","","Guo, Cui; Wang, Pei; Lin, Xiuping; Salendra, Limbadri; Kong, Fandong; Liao, Shengrong; Yang, Bin; Zhou, Xuefeng; Wang, Junfeng; Liu, Yonghong","Phloroglucinol heterodimers and bis-indolyl alkaloids from the sponge-derived fungus Aspergillus sp. SCSIO 41018","Organic Chemistry Frontiers","2019","6","17","3053","","10.1039/C9QO00351G","","x-ray","1.54184","CuKα","","0.0361","0.0333","","","0.0883","0.0915","","","","","","1.081","","","","has coordinates","238170","2020-10-21","18:00:00",""
"1554876","14.3037","0.0001","14.0845","0.0001","23.7866","0.0002","90","","91.922","0.001","90","","4789.36","0.06","104","7","104","7","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C29 H27 N2 O4.5 -","- C29 H27 N2 O4.5 -","- C232 H216 N16 O36 -","8","2","","Guo, Cui; Wang, Pei; Lin, Xiuping; Salendra, Limbadri; Kong, Fandong; Liao, Shengrong; Yang, Bin; Zhou, Xuefeng; Wang, Junfeng; Liu, Yonghong","Phloroglucinol heterodimers and bis-indolyl alkaloids from the sponge-derived fungus Aspergillus sp. SCSIO 41018","Organic Chemistry Frontiers","2019","6","17","3053","","10.1039/C9QO00351G","","x-ray","1.54184","CuKα","","0.0433","0.0414","","","0.1125","0.1141","","","","","","1.032","","","","has coordinates","275434","2022-05-16","05:31:57",""
"1554879","8.09067","0.00008","25.4976","0.0003","41.3088","0.0004","90","","90","","90","","8521.7","0.15","101","2","101","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28.33333 H40.33333 N O9.33333 -","- C28.3333 H40.3333 N O9.33333 -","- C340 H484 N12 O112 -","12","3","","Guo, Cui; Wang, Pei; Lin, Xiuping; Salendra, Limbadri; Kong, Fandong; Liao, Shengrong; Yang, Bin; Zhou, Xuefeng; Wang, Junfeng; Liu, Yonghong","Phloroglucinol heterodimers and bis-indolyl alkaloids from the sponge-derived fungus Aspergillus sp. SCSIO 41018","Organic Chemistry Frontiers","2019","6","17","3053","","10.1039/C9QO00351G","","x-ray","1.54184","CuKα","","0.0426","0.037","","","0.0941","0.0974","","","","","","1.046","","","","has coordinates","275856","2022-06-07","07:08:27",""
"1554881","12.0924","0.001","16.7422","0.0011","8.278","0.0007","90","","107.825","0.009","90","","1595.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H23 N O4 -","- C17 H23 N O4 -","- C68 H92 N4 O16 -","4","1","","Zhang, Zhen; Tu, Yong-Qiang; Zhang, Xiao-Ming; Zhang, Fu-Min; Wang, Shao-Hua","Copper-catalyzed highly diastereoselective cross-dehydrogenative coupling between 8-hydroxyisochromanes and 1,3-dicarbonyl compounds","Organic Chemistry Frontiers","2019","6","13","2275","","10.1039/C9QO00353C","","","0.71073","MoKα","","0.0862","0.0579","","","0.1284","0.1514","","","","","","1.051","","","","has coordinates","238177","2020-10-21","18:00:00",""
"1554882","6.4241","0.0006","10.1906","0.0011","11.3167","0.0014","68.951","0.011","83.144","0.009","83.818","0.008","684.79","0.14","294.9","0.7","294.9","0.7","","","","","","","","4","P -1","-P 1","2","","","","- C14 H13 F3 O5 -","- C14 H13 F3 O5 -","- C28 H26 F6 O10 -","2","1","","Zhang, Zhen; Tu, Yong-Qiang; Zhang, Xiao-Ming; Zhang, Fu-Min; Wang, Shao-Hua","Copper-catalyzed highly diastereoselective cross-dehydrogenative coupling between 8-hydroxyisochromanes and 1,3-dicarbonyl compounds","Organic Chemistry Frontiers","2019","6","13","2275","","10.1039/C9QO00353C","","","1.54184","CuKα","","0.0494","0.0415","","","0.1124","0.122","","","","","","1.033","","","","has coordinates","238177","2020-10-21","18:00:00",""
"1554883","12.1636","0.0011","10.2486","0.0007","12.3402","0.0011","90","","110.011","0.01","90","","1445.5","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 O4 -","- C17 H20 O4 -","- C68 H80 O16 -","4","1","","Zhang, Zhen; Tu, Yong-Qiang; Zhang, Xiao-Ming; Zhang, Fu-Min; Wang, Shao-Hua","Copper-catalyzed highly diastereoselective cross-dehydrogenative coupling between 8-hydroxyisochromanes and 1,3-dicarbonyl compounds","Organic Chemistry Frontiers","2019","6","13","2275","","10.1039/C9QO00353C","","","0.71073","MoKα","","0.0858","0.0532","","","0.1195","0.1438","","","","","","1.032","","","","has coordinates","238177","2020-10-21","18:00:00",""
"1554884","7.6075","0.001","9.2096","0.0012","19.424","0.003","90","","98.561","0.002","90","","1345.7","0.3","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 O4 -","- C16 H18 O4 -","- C64 H72 O16 -","4","1","","Zhang, Zhen; Tu, Yong-Qiang; Zhang, Xiao-Ming; Zhang, Fu-Min; Wang, Shao-Hua","Copper-catalyzed highly diastereoselective cross-dehydrogenative coupling between 8-hydroxyisochromanes and 1,3-dicarbonyl compounds","Organic Chemistry Frontiers","2019","6","13","2275","","10.1039/C9QO00353C","","","0.71073","MoKα","","0.0541","0.0419","","","0.1348","0.1506","","","","","","0.998","","","","has coordinates","238177","2020-10-21","18:00:00",""
"1554886","10.9357","0.0005","11.7723","0.0006","24.8931","0.0009","90","","90","","90","","3204.7","0.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C33 H27 Cl3 N2 O5 S -","- C33 H27 Cl3 N2 O5 S -","- C132 H108 Cl12 N8 O20 S4 -","4","1","","Ren, Xiao-Rui; Lin, Jun-Bing; Hu, Xiu-Qin; Xu, Peng-Fei","Bifunctional Brønsted base catalyzed inverse-electron-demand aza-Diels‒Alder reactions of saccharin-derived 1-azadienes with azlactones","Organic Chemistry Frontiers","2019","6","13","2280","","10.1039/C9QO00357F","","","0.71073","MoKα","","0.0793","0.056","","","0.1179","0.1352","","","","","","1.048","","","","has coordinates,has disorder","238179","2020-10-21","18:00:00",""
"1554888","5.4632","0.0004","16.8139","0.0011","10.7302","0.0007","90","","98.574","0.002","90","","974.64","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3.33 H3 N0.33 O0.33 Se0.33 -","- C3.33333 H3 N0.333333 O0.333333 Se0.333333 -","- C40 H36 N4 O4 Se4 -","12","3","","Xiao, Jun-An; Li, Yu-Chun; Cheng, Xiu-Liang; Chen, Wen-Qiang; Cui, Jian-Guo; Huang, Yan-Min; Huang, Jun; Xiao, Qi; Su, Wei; Yang, Hua","Selenocyanobenziodoxolone: a practical electrophilic selenocyanation reagent and its application for solid-state synthesis of α-carbonyl selenocyanates","Organic Chemistry Frontiers","2019","6","12","1967","","10.1039/C9QO00358D","","","0.71073","MoKα","","0.0768","0.0387","","","0.0749","0.0859","","","","","","1.026","","","","has coordinates","238181","2020-10-21","18:00:00",""
"1554889","10.1323","0.0006","7.4394","0.0005","15.4852","0.001","90","","100.787","0.002","90","","1146.62","0.13","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C3.43 H4.71 N0.14 O0.43 Se0.14 -","- C3.42857 H4.71429 N0.142857 O0.428571 Se0.142857 -","- C48 H66 N2 O6 Se2 -","14","7","","Xiao, Jun-An; Li, Yu-Chun; Cheng, Xiu-Liang; Chen, Wen-Qiang; Cui, Jian-Guo; Huang, Yan-Min; Huang, Jun; Xiao, Qi; Su, Wei; Yang, Hua","Selenocyanobenziodoxolone: a practical electrophilic selenocyanation reagent and its application for solid-state synthesis of α-carbonyl selenocyanates","Organic Chemistry Frontiers","2019","6","12","1967","","10.1039/C9QO00358D","","","0.71073","MoKα","","0.0547","0.0362","","","0.0786","0.0849","","","","","","1.023","","","","has coordinates","238181","2020-10-21","18:00:00",""
"1554891","7.229","0.004","11.212","0.006","22.921","0.012","90","","90","","90","","1857.8","1.7","296.15","","296.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H21 Cl O5 -","- C21 H21 Cl O5 -","- C84 H84 Cl4 O20 -","4","1","","Lv, Xue-Jiao; Zhao, Wei-Wei; Chen, Ying-Han; Wan, Sheng-Biao; Liu, Yan-Kai","Organocatalytic asymmetric synthesis of both cis- and trans-configured pyrano[2,3-b]chromenes via different dehydration pathways","Organic Chemistry Frontiers","2019","6","12","1972","","10.1039/C9QO00366E","","","0.71073","MoKα","","0.1004","0.0738","","","0.1835","0.2015","","","","","","1.002","","","","has coordinates","238183","2020-10-21","18:00:00",""
"1554892","10.3231","0.0013","8.3376","0.001","10.651","0.0013","90","","116.926","0.002","90","","817.35","0.17","100.15","","100.15","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H18 O4 -","- C20 H18 O4 -","- C40 H36 O8 -","2","1","","Lv, Xue-Jiao; Zhao, Wei-Wei; Chen, Ying-Han; Wan, Sheng-Biao; Liu, Yan-Kai","Organocatalytic asymmetric synthesis of both cis- and trans-configured pyrano[2,3-b]chromenes via different dehydration pathways","Organic Chemistry Frontiers","2019","6","12","1972","","10.1039/C9QO00366E","","","0.71073","MoKα","","0.0432","0.0357","","","0.0852","0.0905","","","","","","1.048","","","","has coordinates","238183","2020-10-21","18:00:00",""
"1554893","10.5134","0.0013","7.5193","0.0009","22.921","0.003","90","","90","","90","","1812","0.4","296.15","","296.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H19 Cl O4 -","- C21 H19 Cl O4 -","- C84 H76 Cl4 O16 -","4","1","","Lv, Xue-Jiao; Zhao, Wei-Wei; Chen, Ying-Han; Wan, Sheng-Biao; Liu, Yan-Kai","Organocatalytic asymmetric synthesis of both cis- and trans-configured pyrano[2,3-b]chromenes via different dehydration pathways","Organic Chemistry Frontiers","2019","6","12","1972","","10.1039/C9QO00366E","","","0.71073","MoKα","","0.0627","0.0472","","","0.1089","0.119","","","","","","1.036","","","","has coordinates","238183","2020-10-21","18:00:00",""
"1554895","14.05","0.0011","8.3338","0.0006","14.2852","0.0011","90","","101.509","0.001","90","","1639","0.2","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-ethyl-3-nitro-1-tosyl-1H-indazole","","- C16 H15 N3 O4 S -","- C16 H15 N3 O4 S -","- C64 H60 N12 O16 S4 -","4","1","","Wang, Guodong; Sun, Jian; Wang, Kai; Han, Junfen; Li, Hongshuang; Duan, Guiyun; You, Guirong; Li, Furong; Xia, Chengcai","Palladium-catalyzed direct C‒H nitration and intramolecular C‒H functionalization for the synthesis of 3-nitro-1-(phenylsulfonyl)-1H-indazole derivatives","Organic Chemistry Frontiers","2019","6","10","1608","","10.1039/C9QO00367C","","","0.71073","MoKα","","0.0499","0.0408","","","0.1057","0.1132","","","","","","1.042","","","","has coordinates","238185","2020-10-21","18:00:00",""
"1554897","7.9218","0.0011","6.5193","0.0008","13.434","0.0016","90","","101.58","0.004","90","","679.67","0.15","173","1","173","1","","","","","","","","4","P 1 21 1","P 2yb","4","","Benzyl 8-azaspiro[bicyclo[3.2.1]octane-(exo)-3,2?-oxirane]-8-carboxylate","","- C16 H19 N O3 -","- C16 H19 N O3 -","- C32 H38 N2 O6 -","2","1","","Mandzhulo, Aleksandr; Vashchenko, Iryna; Gerasov, Andrii; Vovk, Mykhaylo; Rusanov, Eduard; Fetyukhin, Volodymyr; Lukin, Oleg; Shivanyuk, Alexander","Selective synthesis of N-protected exo-spiro[oxirane-3,2′-tropanes]","Organic Chemistry Frontiers","2019","6","10","1692","","10.1039/C9QO00377K","","","0.71073","MoKα","","0.0391","0.0337","","","0.0751","0.0772","","","","","","1.047","","","","has coordinates","238187","2020-10-21","18:00:00",""
"1554899","8.9194","0.0008","12.8315","0.0012","18.5057","0.0018","90","","90","","90","","2118","0.3","293","2","293.15","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H36 O3 -","- C24 H36 O3 -","- C96 H144 O12 -","4","1","","Zhao, Nan; Xie, Shengling; Tian, Peilin; Tong, Rongbiao; Ning, Chengqing; Xu, Jing","Asymmetric total synthesis of (+)-astellatol and (−)-astellatene","Organic Chemistry Frontiers","2019","6","12","2014","","10.1039/C9QO00384C","","","1.54184","CuKα","","0.0724","0.0659","","","0.1672","0.1734","","","","","","1.069","","","","has coordinates","238189","2020-10-21","18:00:00",""
"1554901","9.9964","0.0003","10.5385","0.0003","17.4587","0.0005","90","","90","","90","","1839.22","0.09","100.01","0.1","100.01","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H30 O4 -","- C20 H30 O4 -","- C80 H120 O16 -","4","1","","Zhang, Jing; Tang, Xuli; Han, Xiao; Feng, Danqing; Luo, Xiangchao; Ofwegen, Leen van; Li, Pinglin; Li, Guoqiang","Sarcoglaucins A-I, new antifouling cembrane-type diterpenes from the South China Sea soft coral Sarcophyton glaucum","Organic Chemistry Frontiers","2019","6","12","2004","","10.1039/C9QO00386J","","x-ray","1.54184","CuKα","","0.042","0.0365","","","0.0822","0.0857","","","","","","1.039","","","","has coordinates","238192","2020-10-21","18:00:00",""
"1554903","6.5666","0.0003","16.4713","0.0006","8.0376","0.0004","90","","111.405","0.005","90","","809.39","0.07","180","0.1","180","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H20 N2 O3 -","- C19 H20 N2 O3 -","- C38 H40 N4 O6 -","2","1","","Wang, Bo; Wang, Yuankai; Wang, Zixuan; Wang, Jianbo","Rh(i)-Catalyzed intramolecular [2 + 2 + 1] cycloaddition of diynes with the N-terminal of the diazo group","Organic Chemistry Frontiers","2019","6","14","2329","","10.1039/C9QO00403C","","","0.71073","MoKα","","0.0377","0.0347","","","0.0855","0.088","","","","","","1.057","","","","has coordinates","238194","2020-10-21","18:00:00",""
"1554905","15.1446","0.0014","24.455","0.002","20.982","0.003","90","","93.45","0.003","90","","7756.8","1.5","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C45 H42 F4 O7 -","- C45 H42 F4 O7 -","- C360 H336 F32 O56 -","8","1","","Wu, Tuoqi; Senior, James; Bremner, Glen; Finden, Jeremy; Branda, Neil R.","Unusual structural changes as a result of weathering benzofuran-based diarylethenes in simulated sunlight","Organic Chemistry Frontiers","2019","6","12","1961","","10.1039/C9QO00409B","","","0.71073","MoKα","","0.0658","0.0493","","","0.129","0.1405","","","","","","1.041","","","","has coordinates","238196","2020-10-21","18:00:00",""
"1554906","11.4709","0.0017","13.897","0.002","14.895","0.002","107.986","0.004","112.427","0.004","96.387","0.005","2015.5","0.5","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C47 H45 F4 O7 -","- C47 H45 F4 O7 -","- C94 H90 F8 O14 -","2","1","","Wu, Tuoqi; Senior, James; Bremner, Glen; Finden, Jeremy; Branda, Neil R.","Unusual structural changes as a result of weathering benzofuran-based diarylethenes in simulated sunlight","Organic Chemistry Frontiers","2019","6","12","1961","","10.1039/C9QO00409B","","","0.71073","MoKα","","0.1248","0.0777","","","0.2288","0.2729","","","","","","1.082","","","","has coordinates","238196","2020-10-21","18:00:00",""
"1554908","10.273","0.004","10.178","0.004","16.954","0.007","90","","99.61","0.006","90","","1747.8","1.2","296","2","296.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 N O -","- C24 H19 N O -","- C96 H76 N4 O4 -","4","1","","Zhao, Hong-Ping; Ma, Xiao-Pan; Nie, Shu-Min; Xiao, Yuhong; Mo, Dong-Liang","Synthesis of chromeno[4,3-b]quinolines and spirobenzofuran-3,3′-quinolines through silver-mediated Appel reaction/C‒Br bond cleavage/double selective rearrangement sequence","Organic Chemistry Frontiers","2019","6","14","2334","","10.1039/C9QO00417C","","","0.71073","MoKα","","0.0504","0.0408","","","0.1109","0.1202","","","","","","1.041","","","","has coordinates","238198","2020-10-21","18:00:00",""
"1554910","10.5982","0.0007","10.2369","0.0007","20.9415","0.0014","90","","99.629","0.001","90","","2240","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H21 N O2 -","- C30 H21 N O2 -","- C120 H84 N4 O8 -","4","1","","Wang, Jian; Cai, Panyuan; He, Yimiao; Liu, Yuan; Zhong, Ling; Ding, Shumin; Shang, Yongjia","Tuneable access to isoquinolines via a transition-metal-free C(sp3)‒C(sp3) bond cleavage rearrangement reaction","Organic Chemistry Frontiers","2019","6","14","2430","","10.1039/C9QO00427K","","","0.71073","MoKα","","0.062","0.0426","","","0.0977","0.1085","","","","","","1.02","","","","has coordinates","238200","2020-10-21","18:00:00",""
"1554911","10.7138","0.0003","10.8978","0.0003","12.099","0.0003","92.748","0.001","96.702","0.001","90.476","0.001","1401.24","0.07","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H29 F6 N2 O P Ru -","- C27 H29 F6 N2 O P Ru -","- C54 H58 F12 N4 O2 P2 Ru2 -","2","1","","Hong, Xi; Zhou, Quan; Huang, Shuang; Cui, He-Zhen; Li, Zhi-Ming; Hou, Xiu-Feng","Transition metal catalysed C7 and ortho-selective halogenation of 2-arylbenzo[d]oxazoles","Organic Chemistry Frontiers","2019","6","13","2226","","10.1039/C9QO00429G","","","1.34138","GaKα","","0.0258","0.0242","","","0.0648","0.0659","","","","","","1.053","","","","has coordinates,has disorder","238201","2020-10-21","18:00:00",""
"1554913","6.8959","0.0008","7.1261","0.0006","24.02","0.003","90","","90","","90","","1180.4","0.2","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H12 N2 O -","- C14 H12 N2 O -","- C56 H48 N8 O4 -","4","1","","Feng, Guang-Shou; Zhao, Zi-Biao; Shi, Lei; Zhou, Yong-Gui","Iridium-catalyzed asymmetric hydrogenation of quinazolinones","Organic Chemistry Frontiers","2019","6","13","2250","","10.1039/C9QO00443B","","","1.54178","CuKα","","0.1156","0.0683","","","0.1729","0.2048","","","","","","0.912","","","","has coordinates","238203","2020-10-21","18:00:00",""
"1554918","8.4795","0.0001","18.0358","0.0001","21.5437","0.0001","90","","90","","90","","3294.78","0.05","100","0.1","100","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C35 H27 Br F3 N3 O3 -","- C35 H27 Br F3 N3 O3 -","- C140 H108 Br4 F12 N12 O12 -","4","1","","Zhao, Xiaoyun; Xiong, Jiale; An, Junkai; Yu, Jicong; Zhu, Liping; Feng, Xing; Jiang, Xianxing","Diastereodivergent construction of bispiro[oxindole-bi-pyrrolidine]s with four consecutive stereocenters via asymmetric [3 + 2] cycloaddition of 2,3-dioxopyrrolidines using identical catalysts","Organic Chemistry Frontiers","2019","6","12","1989","","10.1039/C9QO00452A","","x-ray","1.54184","CuKα","","0.0591","0.0577","","","0.1511","0.1528","","","","","","1.041","","","","has coordinates","238208","2020-10-21","18:00:00",""
"1554919","11.9726","0.0002","16.0021","0.0003","18.2529","0.0004","90","","90","","90","","3497.01","0.12","149.99","0.1","149.99","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C40 H31 Cl2 F4 N2 O3 -","- C40 H32 Cl2 F3 N3 O3 -","- C160 H128 Cl8 F12 N12 O12 -","4","1","","Zhao, Xiaoyun; Xiong, Jiale; An, Junkai; Yu, Jicong; Zhu, Liping; Feng, Xing; Jiang, Xianxing","Diastereodivergent construction of bispiro[oxindole-bi-pyrrolidine]s with four consecutive stereocenters via asymmetric [3 + 2] cycloaddition of 2,3-dioxopyrrolidines using identical catalysts","Organic Chemistry Frontiers","2019","6","12","1989","","10.1039/C9QO00452A","","x-ray","1.54184","CuKα","","0.0556","0.0528","","","0.1401","0.1448","","","","","","1.026","","","","has coordinates,has disorder","238208","2020-10-21","18:00:00",""
"1554922","21.4324","0.0012","13.5256","0.0008","8.8733","0.0005","90","","90","","90","","2572.2","0.3","292.94","0.1","292.94","0.1","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C31 H28 N2 O5 -","- C31 H28 N2 O5 -","- C124 H112 N8 O20 -","4","1","","Zhang, Si-Chen; Lei, Xin-Xin; Yang, Yong-jian; Luo, Yong-Chun; Zhang, Huan-Huan; Xu, Peng-Fei","Palladium catalysed [3 + 2]-annulation reaction of vinylcyclopropanes with pentafulvenes: synthesis of polysubstituted spiro[4,4]nona-6,8-dienes","Organic Chemistry Frontiers","2019","6","14","2415","","10.1039/C9QO00467J","","","0.71073","MoKα","","0.0811","0.0502","","","0.0894","0.1086","","","","","","1.055","","","","has coordinates","238211","2020-10-21","18:00:00",""
"1554923","8.9859","0.0013","10.004","0.002","15.8029","0.0018","97.57","0.013","90.211","0.011","115.564","0.017","1267.4","0.4","293","0.1","293","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C30 H25 N3 O3 -","- C30 H25 N3 O3 -","- C60 H50 N6 O6 -","2","1","","Zhang, Si-Chen; Lei, Xin-Xin; Yang, Yong-jian; Luo, Yong-Chun; Zhang, Huan-Huan; Xu, Peng-Fei","Palladium catalysed [3 + 2]-annulation reaction of vinylcyclopropanes with pentafulvenes: synthesis of polysubstituted spiro[4,4]nona-6,8-dienes","Organic Chemistry Frontiers","2019","6","14","2415","","10.1039/C9QO00467J","","x-ray","1.54184","CuKα","","0.0585","0.0458","","","0.1141","0.1273","","","","","","1.029","","","","has coordinates","238211","2020-10-21","18:00:00",""
"1554925","9.1965","0.0003","9.694","0.0004","38.3086","0.0014","90","","90","","90","","3415.2","0.2","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C38 H31 Br Cl3 N3 O4 -","- C38 H31 Br Cl3 N3 O4 -","- C152 H124 Br4 Cl12 N12 O16 -","4","1","","Zhang, Jing; Chan, Wai-Lun; Chen, Ligong; Ullah, Nisar; Lu, Yixin","Creation of bispiro[pyrazolone-3,3′-oxindoles] via a phosphine-catalyzed enantioselective [3 + 2] annulation of the Morita‒Baylis‒Hillman carbonates with pyrazoloneyldiene oxindoles","Organic Chemistry Frontiers","2019","6","13","2210","","10.1039/C9QO00471H","","","1.54178","CuKα","","0.0252","0.0249","","","0.0597","0.0599","","","","","","1.082","","","","has coordinates,has disorder","238213","2020-10-21","18:00:00",""
"1554927","20.961","0.008","20.961","0.008","7.086","0.003","90","","90","","120","","2696.2","1.8","273","2","273.15","","","","","","","","","3","R 3 :H","R 3","146","","","","- C16 H18 O -","- C16 H18 O -","- C144 H162 O9 -","9","1","","Lin, Minggui; Cui, Hao; Hua, Yuhui; Zhang, Yandong","Domino enyne metathesis en route to skeletally diverse, privileged scaffolds: synthesis of the tricyclic core of pseudolaric acid F","Organic Chemistry Frontiers","2019","6","15","2771","","10.1039/C9QO00477G","","","0.71073","MoKα","","0.1082","0.0714","","","0.1619","0.1846","","","","","","0.936","","","","has coordinates","238215","2020-10-21","18:00:00",""
"1554928","42.742","0.003","10.4771","0.0009","10.9037","0.0009","90","","93.609","0.006","90","","4873.1","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C27 H34 O3 Si -","- C27 H33.992 O3 Si -","- C216 H271.936 O24 Si8 -","8","1","","Lin, Minggui; Cui, Hao; Hua, Yuhui; Zhang, Yandong","Domino enyne metathesis en route to skeletally diverse, privileged scaffolds: synthesis of the tricyclic core of pseudolaric acid F","Organic Chemistry Frontiers","2019","6","15","2771","","10.1039/C9QO00477G","","","0.71073","MoKα","","0.0939","0.0697","","","0.1464","0.1574","","","","","","1.105","","","","has coordinates,has disorder","238215","2020-10-21","18:00:00",""
"1554929","7.3423","0.001","8.4321","0.0009","10.4623","0.0011","85.681","0.008","85.985","0.01","78.332","0.01","631.55","0.13","185.1","0.6","185.1","0.6","","","","","","","","3","P -1","-P 1","2","","","","- C14 H18 O5 -","- C14 H18 O5 -","- C28 H36 O10 -","2","1","","Lin, Minggui; Cui, Hao; Hua, Yuhui; Zhang, Yandong","Domino enyne metathesis en route to skeletally diverse, privileged scaffolds: synthesis of the tricyclic core of pseudolaric acid F","Organic Chemistry Frontiers","2019","6","15","2771","","10.1039/C9QO00477G","","","0.71073","MoKα","","0.0525","0.0443","","","0.1051","0.11","","","","","","1.034","","","","has coordinates","238215","2020-10-21","18:00:00",""
"1554931","17.4772","0.0006","10.488","0.0005","19.6463","0.0005","90","","90","","90","","3601.2","0.2","296.8","0.2","296.8","0.2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H19 N O4 S -","- C18 H19 N O4 S -","- C144 H152 N8 O32 S8 -","8","1","","Huang, Guofei; Ren, Xiaoyu; Jiang, Chunhui; Wu, Jia-Hong; Gao, Guowei; Wang, Tianli","Efficient synthesis of (E)-2-nitromethylcinnamates via phosphine-catalyzed tandem α-addition and 1,3-rearrangement","Organic Chemistry Frontiers","2019","6","16","2872","","10.1039/C9QO00478E","","x-ray","1.54184","CuKα","","0.0659","0.056","","","0.1629","0.1792","","","","","","0.903","","","","has coordinates","238217","2020-10-21","18:00:00",""
"1554933","15.971","0.004","4.2214","0.0011","13.319","0.003","90","","90","","90","","898","0.4","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C10 H8 N2 S -","- C10 H8 N2 S -","- C40 H32 N8 S4 -","4","1","","Peng, Yingyuan; He, Qian; Zhang, Xiaofei; Yang, Chunhao","Pd-Catalyzed intramolecular C‒H activation and C‒S formation to synthesize pyrazolo[5,1-b]benzothiazoles without an additional oxidant","Organic Chemistry Frontiers","2019","6","18","3234","","10.1039/C9QO00484J","","","0.71073","MoKα","","0.0485","0.0387","","","0.0807","0.0848","","","","","","0.991","","","","has coordinates","238219","2020-10-21","18:00:00",""
"1554936","10.8238","0.0004","10.3557","0.0003","17.8199","0.0007","90","","96.908","0.003","90","","1982.9","0.12","295.91","0.1","295.91","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H21 N3 O4 -","- C20 H21 N3 O4 -","- C80 H84 N12 O16 -","4","1","","Zhang, Xiang; Huang, Qing-Fei; Zou, Wen-Lin; Li, Qing-Zhu; Feng, Xin; Jia, Zhi-Qiang; Liu, Yue; Li, Jun-Long; Wang, Qi-Wei","Synthetic approach to skeletally diverse nitrogen heterocycles from dicyano-2-methylenebut-3-enoates","Organic Chemistry Frontiers","2019","6","19","3321","","10.1039/C9QO00509A","","x-ray","1.54184","CuKα","","0.0737","0.0671","","","0.1697","0.18","","","","","","1.072","","","","has coordinates","238222","2020-10-21","18:00:00",""
"1554938","21.7832","0.0003","21.7832","0.0003","8.49552","0.00015","90","","90","","90","","4031.19","0.11","297.8","0.2","297.8","0.2","","","","","","","","4","P 42 b c","P 4c -2ab","106","","","","- C20 H21 N3 O4 -","- C20 H21 N3 O4 -","- C160 H168 N24 O32 -","8","1","","Zhang, Xiang; Huang, Qing-Fei; Zou, Wen-Lin; Li, Qing-Zhu; Feng, Xin; Jia, Zhi-Qiang; Liu, Yue; Li, Jun-Long; Wang, Qi-Wei","Synthetic approach to skeletally diverse nitrogen heterocycles from dicyano-2-methylenebut-3-enoates","Organic Chemistry Frontiers","2019","6","19","3321","","10.1039/C9QO00509A","","x-ray","1.54184","CuKα","","0.0659","0.0634","","","0.151","0.1561","","","","","","1.063","","","","has coordinates","238224","2020-10-21","18:00:00",""
"1554939","6.9944","0.0003","7.8586","0.0004","26.1858","0.0011","85.696","0.004","89.837","0.004","79.658","0.004","1411.87","0.11","296.9","0.6","296.9","0.6","","","","","","","","4","P -1","-P 1","2","","","","- C15 H13 N3 O2 -","- C15 H13 N3 O2 -","- C60 H52 N12 O8 -","4","2","","Zhang, Xiang; Huang, Qing-Fei; Zou, Wen-Lin; Li, Qing-Zhu; Feng, Xin; Jia, Zhi-Qiang; Liu, Yue; Li, Jun-Long; Wang, Qi-Wei","Synthetic approach to skeletally diverse nitrogen heterocycles from dicyano-2-methylenebut-3-enoates","Organic Chemistry Frontiers","2019","6","19","3321","","10.1039/C9QO00509A","","x-ray","1.54184","CuKα","","0.0788","0.0706","","","0.1941","0.2078","","","","","","1.019","","","","has coordinates","273808","2022-03-18","10:32:15",""
"1554940","9.69927","0.00009","10.835","0.00009","16.94975","0.00013","90","","90","","90","","1781.28","0.03","150","0.1","150","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H18 F3 N O3 -","- C22 H18 F3 N O3 -","- C88 H72 F12 N4 O12 -","4","1","","Rabasa-Alcañiz, Fernando; Hammerl, Daniel; Sánchez-Merino, Anabel; Tejero, Tomás; Merino, Pedro; Fustero, Santos; del Pozo, Carlos","Asymmetric synthesis of polycyclic 3-fluoroalkylproline derivatives by intramolecular azomethine ylide cycloaddition","Organic Chemistry Frontiers","2019","6","16","2916","","10.1039/C9QO00525K","","x-ray","1.54184","CuKα","","0.0275","0.0271","","","0.0688","0.0691","","","","","","1.076","","","","has coordinates","238225","2020-10-21","18:00:00",""
"1554942","15.5529","0.0006","7.3629","0.0003","19.8862","0.0006","90","","90","","90","","2277.26","0.15","170","2","170.01","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C26 H20 Cu F6 P -","- C26 H20 Cu F6 P -","- C104 H80 Cu4 F24 P4 -","4","0.5","","Liu, He; Shen, Qilong","Bistrifluoromethylated organocuprate [Ph4P]+[Cu(CF3)2]−: synthesis, characterization and its application for trifluoromethylation of activated heteroaryl bromides, chlorides and iodides","Organic Chemistry Frontiers","2019","6","14","2324","","10.1039/C9QO00527G","","","0.71073","MoKα","","0.057","0.0459","","","0.1394","0.15","","","","","","1.057","","","","has coordinates","238227","2020-10-21","18:00:00",""
"1554943","10.5905","0.0002","16.0282","0.0004","11.3851","0.0003","90","","116.637","0.001","90","","1727.47","0.07","135","2","135","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","ORGANIC","","","- C20 H22 N2 O4 -","- C20 H22 N2 O4 -","- C80 H88 N8 O16 -","4","1","","Yakkala, Prasanna Anjaneyulu; Giri, Deepesh; Chaudhary, Bharatkumar; Auti, Prashant; Sharma, Satyasheel","Regioselective C‒H alkylation and alkenylation at the C5 position of 2-amino-1,4-naphthoquinones with maleimides under Rh(iii) catalysis","Organic Chemistry Frontiers","2019","6","14","2441","","10.1039/C9QO00538B","","","0.71073","MoKα","","0.0488","0.0397","","","0.1057","0.1129","","","","","","1.051","","","","has coordinates","238228","2020-10-21","18:00:00",""
"1554945","7.5896","0.0008","10.9767","0.0011","11.9609","0.0013","110.338","0.004","100.049","0.004","106.048","0.004","856.49","0.16","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H15 Br2 N O2 -","- C17 H15 Br2 N O2 -","- C34 H30 Br4 N2 O4 -","2","1","","Wang, Yu-Chao; Wang, Rui-Xiang; Qiu, Guanyinsheng; Zhou, Hongwei; Xie, Wenlin; Liu, Jin-Biao","ortho-Amide-directed 2,4-dibromohydration of conjugated enynes","Organic Chemistry Frontiers","2019","6","14","2471","","10.1039/C9QO00540D","","","1.34138","GaKα","","0.0566","0.0484","","","0.1295","0.1367","","","","","","1.05","","","","has coordinates","238230","2020-10-21","18:00:00",""
"1554946","7.2536","0.0006","9.2341","0.0009","9.3515","0.001","85.065","0.008","81.059","0.008","68.355","0.008","574.85","0.1","295.25","0.1","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H12 N2 O -","- C14 H12 N2 O -","- C28 H24 N4 O2 -","2","1","","Su, Han; Bao, Ming; Pei, Chao; Hu, Wenhao; Qiu, Lihua; Xu, Xinfang","Gold-catalyzed dual annulation of azide-tethered alkynes with nitriles: expeditious synthesis of oxazolo[4,5-c]quinolines","Organic Chemistry Frontiers","2019","6","14","2404","","10.1039/C9QO00568D","","","0.71073","MoKα","","0.0923","0.0533","","","0.1358","0.1669","","","","","","1.016","","","","has coordinates","238231","2020-10-21","18:00:00",""
"1554947","9.8811","0.0007","14.4238","0.0007","13.7948","0.0009","90","","109.258","0.007","90","","1856.1","0.2","279","7","279","7","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H15 N3 O -","- C25 H15 N3 O -","- C100 H60 N12 O4 -","4","1","","Su, Han; Bao, Ming; Pei, Chao; Hu, Wenhao; Qiu, Lihua; Xu, Xinfang","Gold-catalyzed dual annulation of azide-tethered alkynes with nitriles: expeditious synthesis of oxazolo[4,5-c]quinolines","Organic Chemistry Frontiers","2019","6","14","2404","","10.1039/C9QO00568D","","x-ray","0.71073","MoKα","","0.0735","0.0468","","","0.1073","0.1255","","","","","","1.0655","","","","has coordinates","238231","2020-10-21","18:00:00",""
"1554949","8.0332","0.0002","8.5272","0.0002","16.9075","0.0004","99.329","0.002","99.436","0.002","101.204","0.002","1097.99","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H23 F2 N O3 S -","- C25 H23 F2 N O3 S -","- C50 H46 F4 N2 O6 S2 -","2","1","","Hu, Xiao-Si; Ding, Pei-Gang; Yu, Jin-Sheng; Zhou, Jian","A Sc(OTf)3 catalyzed Mukaiyama‒Mannich reaction of difluoroenoxysilanes with unactivated ketimines","Organic Chemistry Frontiers","2019","6","14","2500","","10.1039/C9QO00577C","","x-ray","1.54184","CuKα","","0.0419","0.0391","","","0.106","0.108","","","","","","1.073","","","","has coordinates","238233","2020-10-21","18:00:00",""
"1554951","23.8323","0.0016","5.5909","0.0004","15.658","0.0011","90","","103.617","0.007","90","","2027.7","0.3","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C24 H24 O2 S2 -","- C24 H24 O2 S2 -","- C96 H96 O8 S8 -","4","1","","Shoji, Taku; Miura, Kota; Ohta, Akira; Sekiguchi, Ryuta; Ito, Shunji; Endo, Yuya; Nagahata, Tatsuki; Mori, Shigeki; Okujima, Tetsuo","Synthesis of azuleno[2,1-b]thiophenes by cycloaddition of azulenylalkynes with elemental sulfur and their structural, optical and electrochemical properties","Organic Chemistry Frontiers","2019","6","15","2801","","10.1039/C9QO00593E","","","0.71075","MoKα","","0.0959","0.0709","","","0.1475","0.1599","","","","","","1.022","","","","has coordinates,has disorder","238235","2020-10-21","18:00:00",""
"1554952","6.07714","0.00018","13.1618","0.0003","27.1117","0.0008","90","","90","","90","","2168.56","0.1","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H25 N O2 S -","- C25 H25 N O2 S -","- C100 H100 N4 O8 S4 -","4","1","","Shoji, Taku; Miura, Kota; Ohta, Akira; Sekiguchi, Ryuta; Ito, Shunji; Endo, Yuya; Nagahata, Tatsuki; Mori, Shigeki; Okujima, Tetsuo","Synthesis of azuleno[2,1-b]thiophenes by cycloaddition of azulenylalkynes with elemental sulfur and their structural, optical and electrochemical properties","Organic Chemistry Frontiers","2019","6","15","2801","","10.1039/C9QO00593E","","","0.71073","MoKα","","0.0467","0.0402","","","0.0867","0.0895","","","","","","1.03","","","","has coordinates","238235","2020-10-21","18:00:00",""
"1554953","13.9336","0.0007","19.7182","0.0009","20.3209","0.0011","90","","103.298","0.005","90","","5433.4","0.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H30.52 O4.26 S -","- C32 H30.516 O4.258 S -","- C256 H244.128 O34.064 S8 -","8","1","","Shoji, Taku; Miura, Kota; Ohta, Akira; Sekiguchi, Ryuta; Ito, Shunji; Endo, Yuya; Nagahata, Tatsuki; Mori, Shigeki; Okujima, Tetsuo","Synthesis of azuleno[2,1-b]thiophenes by cycloaddition of azulenylalkynes with elemental sulfur and their structural, optical and electrochemical properties","Organic Chemistry Frontiers","2019","6","15","2801","","10.1039/C9QO00593E","","","0.71073","MoKα","","0.1375","0.0847","","","0.207","0.2401","","","","","","1.025","","","","has coordinates,has disorder","238235","2020-10-21","18:00:00",""
"1554954","28.3482","0.0011","19.5347","0.0007","7.5873","0.0003","90","","90","","90","","4201.6","0.3","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C27 H24 Fe O2 S -","- C27 H24 Fe O2 S -","- C216 H192 Fe8 O16 S8 -","8","1","","Shoji, Taku; Miura, Kota; Ohta, Akira; Sekiguchi, Ryuta; Ito, Shunji; Endo, Yuya; Nagahata, Tatsuki; Mori, Shigeki; Okujima, Tetsuo","Synthesis of azuleno[2,1-b]thiophenes by cycloaddition of azulenylalkynes with elemental sulfur and their structural, optical and electrochemical properties","Organic Chemistry Frontiers","2019","6","15","2801","","10.1039/C9QO00593E","","","0.71073","MoKα","","0.0768","0.0497","","","0.0928","0.1026","","","","","","1.046","","","","has coordinates","238235","2020-10-21","18:00:00",""
"1554957","10.1603","0.0005","10.173","0.0004","23.5179","0.001","90","","90","","90","","2430.83","0.18","100","2","100.1","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C27 H22 Cl N O5 S -","- C27 H22 Cl N O5 S -","- C108 H88 Cl4 N4 O20 S4 -","4","1","","Lin, Wei; Lin, Xiao; Cheng, Yuyu; Chang, Xiaoyong; Zhou, San; Li, Pengfei; Li, Wenjun","Organocatalytic enantioselective direct vinylogous Michael addition of γ-substituted deconjugate butenolides to azadienes","Organic Chemistry Frontiers","2019","6","14","2452","","10.1039/C9QO00597H","","x-ray","0.71073","MoKα","","0.03","0.0274","","","0.0661","0.0674","","","","","","1.041","","","","has coordinates","238238","2020-10-21","18:00:00",""
"1554958","10.0757","0.0011","10.4448","0.0009","10.8094","0.0012","90","","92.786","0.003","90","","1136.2","0.2","100","2","100","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H23 N O5 S -","- C27 H23 N O5 S -","- C54 H46 N2 O10 S2 -","2","1","","Lin, Wei; Lin, Xiao; Cheng, Yuyu; Chang, Xiaoyong; Zhou, San; Li, Pengfei; Li, Wenjun","Organocatalytic enantioselective direct vinylogous Michael addition of γ-substituted deconjugate butenolides to azadienes","Organic Chemistry Frontiers","2019","6","14","2452","","10.1039/C9QO00597H","","x-ray","0.71073","MoKα","","0.0293","0.028","","","0.0705","0.0714","","","","","","1.031","","","","has coordinates","238238","2020-10-21","18:00:00",""
"1554961","9.8296","0.0013","13.4413","0.0017","22.608","0.003","90","","94.433","0.003","90","","2978.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H29 N O3 S -","- C30 H29 N O3 S -","- C120 H116 N4 O12 S4 -","4","1","","Rui, Kang-Hua; Yang, Song; Wei, Yin; Shi, Min","Rh(i)-Catalyzed stereoselective intramolecular cycloaddition reactions of ene-vinylidenecyclopropanes for the construction of fused 6,5-bicyclic skeletons with a quaternary all-carbon stereocenter","Organic Chemistry Frontiers","2019","6","14","2506","","10.1039/C9QO00611G","","","0.71073","MoKα","","0.1107","0.0682","","","0.1582","0.1781","","","","","","1.042","","","","has coordinates","238241","2020-10-21","18:00:00",""
"1554962","5.8832","0.0002","8.7875","0.0002","37.5443","0.0011","90","","90","","90","","1940.99","0.1","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H27 N O2 S -","- C20 H27 N O2 S -","- C80 H108 N4 O8 S4 -","4","1","","Rui, Kang-Hua; Yang, Song; Wei, Yin; Shi, Min","Rh(i)-Catalyzed stereoselective intramolecular cycloaddition reactions of ene-vinylidenecyclopropanes for the construction of fused 6,5-bicyclic skeletons with a quaternary all-carbon stereocenter","Organic Chemistry Frontiers","2019","6","14","2506","","10.1039/C9QO00611G","","","0.71073","MoKα","","0.052","0.0415","","","0.1086","0.1175","","","","","","1.024","","","","has coordinates","238241","2020-10-21","18:00:00",""
"1554963","8.87","0.0016","10.6671","0.0018","21.508","0.004","90","","90","","90","","2035","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H29 N O2 S -","- C22 H29 N O2 S -","- C88 H116 N4 O8 S4 -","4","1","","Rui, Kang-Hua; Yang, Song; Wei, Yin; Shi, Min","Rh(i)-Catalyzed stereoselective intramolecular cycloaddition reactions of ene-vinylidenecyclopropanes for the construction of fused 6,5-bicyclic skeletons with a quaternary all-carbon stereocenter","Organic Chemistry Frontiers","2019","6","14","2506","","10.1039/C9QO00611G","","","0.71073","MoKα","","0.0781","0.0496","","","0.1022","0.1128","","","","","","0.959","","","","has coordinates","238241","2020-10-21","18:00:00",""
"1554964","35.164","0.003","8.6573","0.0006","11.5114","0.0009","90","","94.241","0.002","90","","3494.8","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H23 N O2 S -","- C19 H23 N O2 S -","- C152 H184 N8 O16 S8 -","8","1","","Rui, Kang-Hua; Yang, Song; Wei, Yin; Shi, Min","Rh(i)-Catalyzed stereoselective intramolecular cycloaddition reactions of ene-vinylidenecyclopropanes for the construction of fused 6,5-bicyclic skeletons with a quaternary all-carbon stereocenter","Organic Chemistry Frontiers","2019","6","14","2506","","10.1039/C9QO00611G","","","0.71073","MoKα","","0.0964","0.0583","","","0.1308","0.1549","","","","","","1.054","","","","has coordinates","238241","2020-10-21","18:00:00",""
"1554965","19.505","0.003","8.6857","0.0013","13.1687","0.0016","90","","92.309","0.004","90","","2229.2","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H33 N O2 S -","- C23 H33 N O2 S -","- C92 H132 N4 O8 S4 -","4","1","","Rui, Kang-Hua; Yang, Song; Wei, Yin; Shi, Min","Rh(i)-Catalyzed stereoselective intramolecular cycloaddition reactions of ene-vinylidenecyclopropanes for the construction of fused 6,5-bicyclic skeletons with a quaternary all-carbon stereocenter","Organic Chemistry Frontiers","2019","6","14","2506","","10.1039/C9QO00611G","","","0.71073","MoKα","","0.1115","0.0661","","","0.1559","0.1912","","","","","","1.046","","","","has coordinates","238241","2020-10-21","18:00:00",""
"1554966","10.888","0.003","8.651","0.002","10.91","0.003","90","","97.5","0.005","90","","1018.8","0.5","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H26 Br N O2 S -","- C21 H26 Br N O2 S -","- C42 H52 Br2 N2 O4 S2 -","2","1","","Rui, Kang-Hua; Yang, Song; Wei, Yin; Shi, Min","Rh(i)-Catalyzed stereoselective intramolecular cycloaddition reactions of ene-vinylidenecyclopropanes for the construction of fused 6,5-bicyclic skeletons with a quaternary all-carbon stereocenter","Organic Chemistry Frontiers","2019","6","14","2506","","10.1039/C9QO00611G","","","0.71073","MoKα","","0.0658","0.0461","","","0.1074","0.1167","","","","","","1.029","","","","has coordinates","238241","2020-10-21","18:00:00",""
"1554967","12.551","0.003","11.012","0.002","14.276","0.003","90","","113.904","0.005","90","","1803.9","0.7","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 Br N O2 S -","- C18 H22 Br N O2 S -","- C72 H88 Br4 N4 O8 S4 -","4","1","","Rui, Kang-Hua; Yang, Song; Wei, Yin; Shi, Min","Rh(i)-Catalyzed stereoselective intramolecular cycloaddition reactions of ene-vinylidenecyclopropanes for the construction of fused 6,5-bicyclic skeletons with a quaternary all-carbon stereocenter","Organic Chemistry Frontiers","2019","6","14","2506","","10.1039/C9QO00611G","","","0.71073","MoKα","","0.1743","0.0841","","","0.1987","0.2575","","","","","","1.048","","","","has coordinates","238241","2020-10-21","18:00:00",""
"1554970","10.013","0.005","12.073","0.006","12.827","0.006","111.893","0.015","107.027","0.017","93.776","0.019","1348.7","1.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C17 H14 Cl -","- C17 H14 Cl -","- C68 H56 Cl4 -","4","2","","Fan, Xing; Liu, Ruixing; Wei, Yin; Shi, Min","Rh-Catalyzed intramolecular decarbonylative cyclization of ortho-formyl group tethered alkylidenecyclopropanes (ACPs) for the construction of 2-methylindenes","Organic Chemistry Frontiers","2019","6","15","2667","","10.1039/C9QO00614A","","","0.71073","MoKα","","0.1127","0.0594","","","0.1447","0.1823","","","","","","1.036","","","","has coordinates","238244","2020-10-21","18:00:00",""
"1554972","14.5964","0.0005","13.9382","0.0005","14.6669","0.0005","90","","90","","90","","2983.94","0.18","194","2","194","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C20 H17 N O -","- C20 H17 N O -","- C160 H136 N8 O8 -","8","1","","Hu, Xiaoping; Wang, Gaonan; Qin, Chunxiang; Xie, Xin; Zhang, Chunli; Xu, Wei; Liu, Yuanhong","Ligandless nickel-catalyzed transfer hydrogenation of alkenes and alkynes using water as the hydrogen donor","Organic Chemistry Frontiers","2019","6","15","2619","","10.1039/C9QO00616H","","","0.71073","MoKα","","0.0422","0.0359","","","0.088","0.0931","","","","","","1.034","","","","has coordinates","238246","2020-10-21","18:00:00",""
"1554974","14.929","0.0003","5.74297","0.00008","27.7627","0.0005","90","","104.785","0.0018","90","","2301.48","0.07","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","aminopyrimidine.toluene","","","- C30 H27 N3 -","- C30 H27 N3 -","- C120 H108 N12 -","4","1","","Zhu, Yingzu; Li, Yinghua; Xiang, Shiqun; Fan, Weibin; Jin, Jiang; Huang, Deguang","Utilization of nitriles as the nitrogen source: practical and economical construction of 4-aminopyrimidine and β-enaminonitrile skeletons","Organic Chemistry Frontiers","2019","6","17","3071","","10.1039/C9QO00619B","","","1.54184","CuKα","","0.0428","0.0395","","","0.1034","0.1066","","","","","","1.069","","","","has coordinates","238248","2020-10-21","18:00:00",""
"1554975","15.534","0.0013","6.291","0.0003","15.0837","0.001","90","","113.849","0.009","90","","1348.18","0.18","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 N2 -","- C17 H16 N2 -","- C68 H64 N8 -","4","1","","Zhu, Yingzu; Li, Yinghua; Xiang, Shiqun; Fan, Weibin; Jin, Jiang; Huang, Deguang","Utilization of nitriles as the nitrogen source: practical and economical construction of 4-aminopyrimidine and β-enaminonitrile skeletons","Organic Chemistry Frontiers","2019","6","17","3071","","10.1039/C9QO00619B","","","0.71073","MoKα","","0.0533","0.0451","","","0.1086","0.1147","","","","","","1.057","","","","has coordinates","238248","2020-10-21","18:00:00",""
"1554976","12.9687","0.0003","13.0705","0.0003","7.18","0.0002","90","","90","","90","","1217.06","0.05","100","2","100","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C15 H13 N3 -","- C15 H13 N3 -","- C60 H52 N12 -","4","1","","Zhu, Yingzu; Li, Yinghua; Xiang, Shiqun; Fan, Weibin; Jin, Jiang; Huang, Deguang","Utilization of nitriles as the nitrogen source: practical and economical construction of 4-aminopyrimidine and β-enaminonitrile skeletons","Organic Chemistry Frontiers","2019","6","17","3071","","10.1039/C9QO00619B","","","1.54184","CuKα","","0.0291","0.0286","","","0.0755","0.0758","","","","","","1.075","","","","has coordinates","238248","2020-10-21","18:00:00",""
"1554977","8.8058","0.0008","10.1568","0.0009","10.8636","0.001","112.118","0.009","90.659","0.008","106.96","0.008","852.87","0.15","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H17 N3 -","- C22 H17 N3 -","- C44 H34 N6 -","2","1","","Zhu, Yingzu; Li, Yinghua; Xiang, Shiqun; Fan, Weibin; Jin, Jiang; Huang, Deguang","Utilization of nitriles as the nitrogen source: practical and economical construction of 4-aminopyrimidine and β-enaminonitrile skeletons","Organic Chemistry Frontiers","2019","6","17","3071","","10.1039/C9QO00619B","","","1.54184","CuKα","","0.0765","0.0533","","","0.1464","0.1545","","","","","","1.178","","","","has coordinates","238248","2020-10-21","18:00:00",""
"1554979","14.1655","0.0013","22.469","0.002","16.419","0.0015","90","","98.419","0.001","90","","5169.6","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H24 F2 O5 -","- C30 H24 F2 O5 -","- C240 H192 F16 O40 -","8","2","","Liu, Baohua; Mao, Chunyan; Hu, Qiong; Yao, Liangliang; Hu, Yimin","Direct methylation and carbonylation of in situ generated arynes via HDDA-Wittig coupling","Organic Chemistry Frontiers","2019","6","15","2788","","10.1039/C9QO00621D","","","0.71073","MoKα","","0.1689","0.1089","","","0.3402","0.3959","","","","","","1.349","","","","has coordinates","238250","2020-10-21","18:00:00",""
"1554980","9.9135","0.0004","11.2232","0.0004","13.3885","0.0005","94.007","0.002","107.02","0.001","109.916","0.001","1315.15","0.09","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H12 F O3 -","- C15 H12 F O3 -","- C60 H48 F4 O12 -","4","2","","Liu, Baohua; Mao, Chunyan; Hu, Qiong; Yao, Liangliang; Hu, Yimin","Direct methylation and carbonylation of in situ generated arynes via HDDA-Wittig coupling","Organic Chemistry Frontiers","2019","6","15","2788","","10.1039/C9QO00621D","","","0.71073","MoKα","","0.084","0.0692","","","0.2028","0.2261","","","","","","0.987","","","","has coordinates,has disorder","238250","2020-10-21","18:00:00",""
"1554983","17.251","0.002","12.1706","0.0017","26.112","0.004","90","","91.879","0.003","90","","5479.4","1.3","113","2","113.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 B11 Cl6 O -","- C19 H19 B11 Cl6 O -","- C152 H152 B88 Cl48 O8 -","8","2","","Lu, Mengsi; Allemann, Oliver; Xu, Jun; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S.","Peraryl-X-onium ions of nitrogen and oxygen","Organic Chemistry Frontiers","2019","6","15","2640","","10.1039/C9QO00633H","","","0.71073","MoKα","","0.0697","0.0467","","","0.0989","0.1119","","","","","","1.083","","","","has coordinates","238253","2020-10-21","18:00:00",""
"1554984","19.0146","0.0006","13.8372","0.0003","21.2518","0.0005","90","","90","","90","","5591.5","0.3","113.15","","113.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H21 B11 Cl6 O -","- C20 H21 B11 Cl6 O -","- C160 H168 B88 Cl48 O8 -","8","1","","Lu, Mengsi; Allemann, Oliver; Xu, Jun; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S.","Peraryl-X-onium ions of nitrogen and oxygen","Organic Chemistry Frontiers","2019","6","15","2640","","10.1039/C9QO00633H","","x-ray","0.71073","MoKα","","0.0452","0.0392","","","0.1062","0.1098","","","","","","1.043","","","","has coordinates","238253","2020-10-21","18:00:00",""
"1554985","18.70332","0.00019","18.4574","0.0003","18.4002","0.00017","90","","90","","90","","6352.02","0.14","160","2","160.15","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C25 H22 B11 Cl6 N -","- C25 H22 B11 Cl6 N -","- C200 H176 B88 Cl48 N8 -","8","1","","Lu, Mengsi; Allemann, Oliver; Xu, Jun; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S.","Peraryl-X-onium ions of nitrogen and oxygen","Organic Chemistry Frontiers","2019","6","15","2640","","10.1039/C9QO00633H","","","0.71073","MoKα","","0.0396","0.0307","","","0.0779","0.0833","","","","","","1.024","","","","has coordinates","238253","2020-10-21","18:00:00",""
"1554986","18.015","0.0002","14.8013","0.0002","23.3476","0.0002","90","","90","","90","","6225.53","0.12","160","2","160","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C25 H22 B11 Cl6 N -","- C25 H22 B11 Cl6 N -","- C200 H176 B88 Cl48 N8 -","8","1","","Lu, Mengsi; Allemann, Oliver; Xu, Jun; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S.","Peraryl-X-onium ions of nitrogen and oxygen","Organic Chemistry Frontiers","2019","6","15","2640","","10.1039/C9QO00633H","","","0.71073","MoKα","","0.0534","0.0396","","","0.0966","0.1059","","","","","","1.024","","","","has coordinates","238253","2020-10-21","18:00:00",""
"1554987","31.445","0.002","13.6072","0.0008","32.634","0.002","90","","116.666","0.001","90","","12478.2","1.3","113","","113","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H24 B11 Cl6 N -","- C25 H24 B11 Cl6 N -","- C400 H384 B176 Cl96 N16 -","16","4","","Lu, Mengsi; Allemann, Oliver; Xu, Jun; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S.","Peraryl-X-onium ions of nitrogen and oxygen","Organic Chemistry Frontiers","2019","6","15","2640","","10.1039/C9QO00633H","","","0.71073","MoKα","","0.1074","0.0711","","","0.1348","0.1534","","","","","","1.179","","","","has coordinates","238253","2020-10-21","18:00:00",""
"1554989","9.943","","19.423","","27.408","","90","","94.84","","90","","5274.24","","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H24 N4 O4 S2 -","- C27 H24 N4 O4 S2 -","- C216 H192 N32 O32 S16 -","8","2","","Wang, Lihong; Wang, Xiaomin; Zhang, Ge; Yang, Shengbiao; Li, Yan; Zhang, Qian","Copper-catalyzed 1,3-aminoazidation of arylcyclopropanes: a facile access to 1,3-diamine derivatives","Organic Chemistry Frontiers","2019","6","16","2934","","10.1039/C9QO00638A","","","0.71073","MoKα","","0.0899","0.0549","","","0.1647","0.2051","","","","","","0.819","","","","has coordinates","274176","2022-03-31","10:10:26",""
"1554991","9.4606","0.0016","8.7844","0.0015","13.698","0.002","90","","91.45","0.004","90","","1138","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 N O3 -","- C13 H11 N O3 -","- C52 H44 N4 O12 -","4","1","","Sun, Yao-Liang; Wei, Yin; Shi, Min","Phosphine-catalyzed fixation of CO2 with γ-hydroxyl alkynone under ambient temperature and pressure: kinetic resolution and further conversion","Organic Chemistry Frontiers","2019","6","14","2420","","10.1039/C9QO00642G","","","0.71073","MoKα","","0.0639","0.0434","","","0.1065","0.1177","","","","","","1.031","","","","has coordinates","238257","2020-10-21","18:00:00",""
"1554992","5.2776","0.0001","10.8907","0.0002","22.1326","0.0004","90","","90","","90","","1272.11","0.04","170","2","170.01","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H13 N O3 -","- C15 H13 N O3 -","- C60 H52 N4 O12 -","4","1","","Sun, Yao-Liang; Wei, Yin; Shi, Min","Phosphine-catalyzed fixation of CO2 with γ-hydroxyl alkynone under ambient temperature and pressure: kinetic resolution and further conversion","Organic Chemistry Frontiers","2019","6","14","2420","","10.1039/C9QO00642G","","","1.34139","GaKα","","0.0331","0.0327","","","0.0874","0.0878","","","","","","1.066","","","","has coordinates","238257","2020-10-21","18:00:00",""
"1554993","11.0859","0.0016","9.2256","0.0013","12.6525","0.0018","90","","101.245","0.003","90","","1269.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 N O5 -","- C14 H11 N O5 -","- C56 H44 N4 O20 -","4","1","","Sun, Yao-Liang; Wei, Yin; Shi, Min","Phosphine-catalyzed fixation of CO2 with γ-hydroxyl alkynone under ambient temperature and pressure: kinetic resolution and further conversion","Organic Chemistry Frontiers","2019","6","14","2420","","10.1039/C9QO00642G","","","0.71073","MoKα","","0.0519","0.0416","","","0.1097","0.1174","","","","","","1.049","","","","has coordinates","238257","2020-10-21","18:00:00",""
"1554995","9.2832","0.0007","10.0044","0.0007","11.107","0.0009","87.027","0.006","65.546","0.008","82.335","0.006","930.61","0.14","173","13","173","13","","","","","","","","5","P -1","-P 1","2","","","","- C23 H18 Cl N O2 -","- C23 H18 Cl N O2 -","- C46 H36 Cl2 N2 O4 -","2","1","","Yao, Yongqi; Yang, Wen; Lin, Qifu; Yang, Weitao; Li, Huanyong; Wang, Lin; Gu, Fenglong; Yang, Dingqiao","1,3-Dipolar cycloaddition of nitrones to oxa(aza)bicyclic alkenes","Organic Chemistry Frontiers","2019","6","19","3360","","10.1039/C9QO00660E","","x-ray","0.71073","MoKα","","0.0775","0.0584","","","0.1265","0.1381","","","","","","1.038","","","","has coordinates","238259","2020-10-21","18:00:00",""
"1554997","6.0211","0.0002","16.1241","0.0005","20.634","0.0005","90","","90","","90","","2003.25","0.1","127","2","127","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H18 N4 O4 S -","- C21 H18 N4 O4 S -","- C84 H72 N16 O16 S4 -","4","1","","Li, Shi-Wu; Du, Yu; Kang, Qiang","A chiral-at-metal asymmetric catalyzed vinylogous Michael addition of ortho-methyl aromatic nitro compounds for isoxazole derivative synthesis","Organic Chemistry Frontiers","2019","6","15","2775","","10.1039/C9QO00676A","","","1.54184","CuKα","","0.104","0.0916","","","0.2275","0.2394","","","","","","1.064","","","","has coordinates","238261","2020-10-21","18:00:00",""
"1554999","10.438","0.005","10.7","0.005","15.172","0.007","80.197","0.009","70.129","0.009","79.638","0.009","1556.7","1.3","296","2","296.15","","","","","","","","","3","P -1","-P 1","2","","","","- C40 H32 O6 -","- C40 H32 O6 -","- C80 H64 O12 -","2","1","","Wang, Wenli; Tang, Yingzhan; Liu, Yongxiang; Yuan, Lei; Wang, Jian; Lin, Bin; Zhou, Di; Sun, Lu; Huang, Renbin; Chen, Gang; Li, Ning","Isolation, structure elucidation, and synthesis of (±)-millpuline A with a suppressive effect in miR-144 expression","Organic Chemistry Frontiers","2019","6","16","2850","","10.1039/C9QO00678H","","","0.71073","MoKα","","0.1055","0.0518","","","0.1228","0.1488","","","","","","1.011","","","","has coordinates","238263","2020-10-21","18:00:00",""
"1555001","19.861","0.008","13.383","0.005","18.29","0.007","90","","117.363","0.011","90","","4318","3","296","2","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H40 N4 Ni O2 -","- C44 H40 N4 Ni O2 -","- C176 H160 N16 Ni4 O8 -","4","1","","Ren, Demin; Fu, Xinliang; Li, Xiaofang; Koniarz, Sebastian; Chmielewski, Piotr J.","Reaction of antiaromatic porphyrinoid with active methylene compounds","Organic Chemistry Frontiers","2019","6","16","2924","","10.1039/C9QO00679F","","","0.71073","MoKα","","0.1009","0.0543","","","0.1273","0.1625","","","","","","1.046","","","","has coordinates","238266","2020-10-21","18:00:00",""
"1555002","14.1112","0.001","4.6513","0.0003","21.124","0.0014","90","","99.827","0.002","90","","1366.14","0.16","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 N2 O4 -","- C15 H16 N2 O4 -","- C60 H64 N8 O16 -","4","1","","Mei, Xiangui; Lan, Mengmeng; Cui, Guodong; Zhang, Hongwei; Zhu, Weiming","Caerulomycins from Actinoalloteichus cyanogriseus WH1-2216-6: isolation, identification and cytotoxicity","Organic Chemistry Frontiers","2019","6","20","3566","","10.1039/C9QO00685K","","","1.54178","CuKα","","0.0757","0.0542","","","0.1284","0.1494","","","","","","1.033","","","","has coordinates","276350","2022-06-28","16:36:21",""
"1555009","15.8263","0.0007","7.7607","0.0003","15.9189","0.0008","90","","106.393","0.002","90","","1875.73","0.15","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 O S -","- C24 H20 O S -","- C96 H80 O4 S4 -","4","1","","Liu, Changqing; Wang, Bo; Guo, Ziyi; Zhang, Jitan; Xie, Meihua","Metal-free cascade rearrangement/radical addition/oxidative C‒H annulation of propargyl alcohols with sodium sulfinates: access to 2-sulfenylindenones","Organic Chemistry Frontiers","2019","6","15","2796","","10.1039/C9QO00688E","","","0.71073","MoKα","","0.1035","0.0665","","","0.1751","0.2046","","","","","","1.031","","","","has coordinates","238269","2020-10-21","18:00:00",""
"1555010","7.3464","0.0002","8.5371","0.0003","15.0907","0.0005","95.337","0.001","91.518","0.001","104.361","0.001","911.69","0.05","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H14 Cl F O S -","- C22 H14 Cl F O S -","- C44 H28 Cl2 F2 O2 S2 -","2","1","","Liu, Changqing; Wang, Bo; Guo, Ziyi; Zhang, Jitan; Xie, Meihua","Metal-free cascade rearrangement/radical addition/oxidative C‒H annulation of propargyl alcohols with sodium sulfinates: access to 2-sulfenylindenones","Organic Chemistry Frontiers","2019","6","15","2796","","10.1039/C9QO00688E","","","0.71073","MoKα","","0.0517","0.0415","","","0.1053","0.1133","","","","","","1.037","","","","has coordinates","238269","2020-10-21","18:00:00",""
"1555013","23.94","0.011","28.05","0.013","23.991","0.011","90","","119.85","0.008","90","","13973","11","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C147 H132 N16 O27 Zn -","- C147 H132 N16 O27 Zn -","- C588 H528 N64 O108 Zn4 -","4","1","","Husain, Ali; Ganesan, Asaithampi; Ghazal, Basma; Durmuş, Mahmut; Zhang, Xian-Fu; Makhseed, Saad","Dual-directional alkyne-terminated macrocycles: Enroute to non-aggregating molecular platforms","Organic Chemistry Frontiers","2019","6","18","3192","","10.1039/C9QO00695H","","","0.71075","MoKα","","0.1687","0.1287","","","0.3375","0.3647","","","","","","1.259","","","","has coordinates,has disorder","238272","2020-10-21","18:00:00",""
"1555014","12.6219","0.0011","16.3765","0.0013","16.6547","0.0014","90","","100.607","0.004","90","","3383.7","0.5","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H32 N2 O6 -","- C38 H32 N2 O6 -","- C152 H128 N8 O24 -","4","1","","Husain, Ali; Ganesan, Asaithampi; Ghazal, Basma; Durmuş, Mahmut; Zhang, Xian-Fu; Makhseed, Saad","Dual-directional alkyne-terminated macrocycles: Enroute to non-aggregating molecular platforms","Organic Chemistry Frontiers","2019","6","18","3192","","10.1039/C9QO00695H","","","1.54178","CuKα","","0.114","0.0825","","","0.1806","0.2071","","","","","","1.132","","","","has coordinates,has disorder","238272","2020-10-21","18:00:00",""
"1555015","4.6619","0.0004","23.4349","0.0019","12.2946","0.0013","90","","97.466","0.006","90","","1331.8","0.2","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H16 O3 -","- C15 H16 O3 -","- C60 H64 O12 -","4","1","","Husain, Ali; Ganesan, Asaithampi; Ghazal, Basma; Durmuş, Mahmut; Zhang, Xian-Fu; Makhseed, Saad","Dual-directional alkyne-terminated macrocycles: Enroute to non-aggregating molecular platforms","Organic Chemistry Frontiers","2019","6","18","3192","","10.1039/C9QO00695H","","","1.54178","CuKα","","0.0936","0.0531","","","0.1186","0.1434","","","","","","1.036","","","","has coordinates","238272","2020-10-21","18:00:00",""
"1555016","12.8844","0.0013","13.9073","0.0013","20.6328","0.0019","98.862","0.007","106.525","0.007","94.899","0.007","3469.4","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C152 H128 N8 O24 Zn -","- C152 H128 N8 O24 Zn -","- C152 H128 N8 O24 Zn -","1","0.5","","Husain, Ali; Ganesan, Asaithampi; Ghazal, Basma; Durmuş, Mahmut; Zhang, Xian-Fu; Makhseed, Saad","Dual-directional alkyne-terminated macrocycles: Enroute to non-aggregating molecular platforms","Organic Chemistry Frontiers","2019","6","18","3192","","10.1039/C9QO00695H","","","0.71075","MoKα","","0.1869","0.138","","","0.384","0.42","","","","","","1.446","","","","has coordinates","238272","2020-10-21","18:00:00",""
"1555017","12.8709","0.0004","15.6947","0.0004","16.5272","0.0005","90","","92.507","0.002","90","","3335.38","0.17","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H30 N4 O6 -","- C36 H30 N4 O6 -","- C144 H120 N16 O24 -","4","1","","Husain, Ali; Ganesan, Asaithampi; Ghazal, Basma; Durmuş, Mahmut; Zhang, Xian-Fu; Makhseed, Saad","Dual-directional alkyne-terminated macrocycles: Enroute to non-aggregating molecular platforms","Organic Chemistry Frontiers","2019","6","18","3192","","10.1039/C9QO00695H","","","1.54178","CuKα","","0.1505","0.0713","","","0.1979","0.2596","","","","","","0.997","","","","has coordinates","238272","2020-10-21","18:00:00",""
"1555020","42.263","0.003","7.4986","0.0007","12.0012","0.001","90","","93.813","0.003","90","","3794.9","0.5","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","5,6,15,16-Tetrahydro-5,16-epoxyhexacene","","- C26 H18 O -","- C26 H18 O -","- C208 H144 O8 -","8","1","","Han, Jian; Liu, Xinbang; Li, Yu; Lou, Zihao; Yi, Mingdong; Kong, Huihui; Luo, Jun","New synthetic approaches for hexacene and its application in thin-film transistors","Organic Chemistry Frontiers","2019","6","16","2839","","10.1039/C9QO00708C","","","0.71073","MoKα","","0.0784","0.058","","","0.1579","0.1726","","","","","","1.022","","","","has coordinates","238274","2020-10-21","18:00:00",""
"1555023","11.0804","0.0003","12.2799","0.0005","13.6018","0.0004","75.764","0.003","84.604","0.003","89.194","0.003","1785.88","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H17 N O2 -","- C24 H17 N O2 -","- C96 H68 N4 O8 -","4","2","","Yang, Zhijia; Pi, Chao; Cui, Xiuling; Wu, Yangjie","One-pot synthesis of pyranoquinolin-1-ones via Rh(iii)-catalysed redox annulation of 3-carboxyquinolines and alkynes","Organic Chemistry Frontiers","2019","6","16","2897","","10.1039/C9QO00710E","","x-ray","0.71073","MoKα","","0.0668","0.0441","","","0.0931","0.1062","","","","","","1.032","","","","has coordinates","238276","2020-10-21","18:00:00",""
"1555024","8.5534","0.0008","5.4976","0.0002","37.5979","0.0018","90","","93.982","0.006","90","","1763.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H17 N O2 -","- C24 H17 N O2 -","- C96 H68 N4 O8 -","4","1","","Yang, Zhijia; Pi, Chao; Cui, Xiuling; Wu, Yangjie","One-pot synthesis of pyranoquinolin-1-ones via Rh(iii)-catalysed redox annulation of 3-carboxyquinolines and alkynes","Organic Chemistry Frontiers","2019","6","16","2897","","10.1039/C9QO00710E","","x-ray","1.54184","CuKα","","0.0824","0.0571","","","0.1361","0.1614","","","","","","1.016","","","","has coordinates","238276","2020-10-21","18:00:00",""
"1555025","6.4787","0.0005","10.7989","0.0007","16.2052","0.0006","79.201","0.004","85.566","0.005","73.057","0.007","1065.03","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H18 F3 N O2 -","- C26 H18 F3 N O2 -","- C52 H36 F6 N2 O4 -","2","1","","Yang, Zhijia; Pi, Chao; Cui, Xiuling; Wu, Yangjie","One-pot synthesis of pyranoquinolin-1-ones via Rh(iii)-catalysed redox annulation of 3-carboxyquinolines and alkynes","Organic Chemistry Frontiers","2019","6","16","2897","","10.1039/C9QO00710E","","x-ray","1.54184","CuKα","","0.1246","0.0857","","","0.2528","0.2922","","","","","","1.06","","","","has coordinates,has disorder","238276","2020-10-21","18:00:00",""
"1555027","10.465","0.002","9.797","0.002","22.032","0.005","90","","95.834","0.003","90","","2247.1","0.8","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H22 O3 S -","- C28 H22 O3 S -","- C112 H88 O12 S4 -","4","1","","Yang, Tao; Kou, Peihao; Jin, Fengyan; Song, Xian-Rong; Bai, Jiang; Ding, Haixin; Xiao, Qiang; Liang, Yong-Min","TFA-promoted sulfonation/cascade cyclization of 2-propynolphenols with sodium sulfinates to 4-sulfonyl 2H-chromenes under metal-free conditions","Organic Chemistry Frontiers","2019","6","17","3162","","10.1039/C9QO00712A","","","0.71073","MoKα","","0.0562","0.0448","","","0.1104","0.1194","","","","","","1.093","","","","has coordinates","238278","2020-10-21","18:00:00",""
"1555029","5.9669","0.0002","11.4767","0.0003","21.9463","0.0007","90","","96.78","0.001","90","","1492.38","0.08","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H15 N O3 S -","- C17 H15 N O3 S -","- C68 H60 N4 O12 S4 -","4","1","","Zhu, Cheng-Zhi; Wei, Yin; Shi, Min","Rhodium(ii)-catalyzed divergent intramolecular tandem cyclization of N- or O-tethered cyclohexa-2,5-dienones with 1-sulfonyl-1,2,3-triazole: synthesis of cyclopropa[cd]indole and benzofuran derivatives","Organic Chemistry Frontiers","2019","6","16","2884","","10.1039/C9QO00714H","","","0.71073","MoKα","","0.0367","0.0331","","","0.086","0.0891","","","","","","1.062","","","","has coordinates","238280","2020-10-21","18:00:00",""
"1555030","7.1629","0.0002","10.9804","0.0004","12.5285","0.0004","102.431","0.001","97.658","0.001","98.768","0.001","936.85","0.05","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H16 Br N O4 S -","- C21 H16 Br N O4 S -","- C42 H32 Br2 N2 O8 S2 -","2","1","","Zhu, Cheng-Zhi; Wei, Yin; Shi, Min","Rhodium(ii)-catalyzed divergent intramolecular tandem cyclization of N- or O-tethered cyclohexa-2,5-dienones with 1-sulfonyl-1,2,3-triazole: synthesis of cyclopropa[cd]indole and benzofuran derivatives","Organic Chemistry Frontiers","2019","6","16","2884","","10.1039/C9QO00714H","","","0.71073","MoKα","","0.0411","0.0368","","","0.1009","0.1042","","","","","","1.055","","","","has coordinates","238280","2020-10-21","18:00:00",""
"1555032","9.0601","0.0008","9.927","0.0009","13.5869","0.0012","82.759","0.002","78.19","0.001","83.39","0.002","1181.56","0.18","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H20 N2 O4 S -","- C27 H20 N2 O4 S -","- C54 H40 N4 O8 S2 -","2","1","","Zhang, Tian-Shu; Wang, Rong; Cai, Pei-Jun; Hao, Wen-Juan; Tu, Shu-Jiang; Jiang, Bo","Silver-catalyzed nitration/annulation of 2-alkynylanilines for a tunable synthesis of nitrated indoles and indazole-2-oxides","Organic Chemistry Frontiers","2019","6","16","2968","","10.1039/C9QO00715F","","","0.71073","MoKα","","0.1066","0.0529","","","0.1289","0.1465","","","","","","1.056","","","","has coordinates","238282","2020-10-21","18:00:00",""
"1555033","12.7222","0.0013","31.291","0.003","7.7018","0.0007","90","","104.211","0.003","90","","2972.2","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29.25 H25.5 Cl0.5 N3 O6 S2 -","- C29.25 H25.5 Cl0.5 N3 O6 S2 -","- C117 H102 Cl2 N12 O24 S8 -","4","1","","Zhang, Tian-Shu; Wang, Rong; Cai, Pei-Jun; Hao, Wen-Juan; Tu, Shu-Jiang; Jiang, Bo","Silver-catalyzed nitration/annulation of 2-alkynylanilines for a tunable synthesis of nitrated indoles and indazole-2-oxides","Organic Chemistry Frontiers","2019","6","16","2968","","10.1039/C9QO00715F","","","0.71073","MoKα","","0.1485","0.0679","","","0.1797","0.2115","","","","","","1.034","","","","has coordinates,has disorder","238282","2020-10-21","18:00:00",""
"1555035","17.9223","0.0005","20.5932","0.0006","21.0729","0.0007","90","","100.834","0.003","90","","7638.9","0.4","151","2","151","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C88 H73 Cl10 N3 Pd -","- C88 H73 Cl10 N3 Pd -","- C352 H292 Cl40 N12 Pd4 -","4","0.5","","Zhang, Fei-Yi; Lan, Xiao-Bing; Xu, Chang; Yao, Hua-Gang; Li, Tian; Liu, Feng-Shou","Rigid hindered N-heterocyclic carbene palladium precatalysts: synthesis, characterization and catalytic amination","Organic Chemistry Frontiers","2019","6","18","3292","","10.1039/C9QO00726A","","","1.54184","CuKα","","0.0821","0.075","","","0.2099","0.2229","","","","","","1.089","","","","has coordinates,has disorder","238284","2020-10-21","18:00:00",""
"1555036","17.6466","0.0004","20.7167","0.0005","20.3473","0.0008","90","","95.896","0.003","90","","7399.2","0.4","281.05","0.1","281.05","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H65 Cl2 N3 O2 Pd -","- C84 H65 Cl2 N3 O2 Pd -","- C336 H260 Cl8 N12 O8 Pd4 -","4","0.5","","Zhang, Fei-Yi; Lan, Xiao-Bing; Xu, Chang; Yao, Hua-Gang; Li, Tian; Liu, Feng-Shou","Rigid hindered N-heterocyclic carbene palladium precatalysts: synthesis, characterization and catalytic amination","Organic Chemistry Frontiers","2019","6","18","3292","","10.1039/C9QO00726A","","","1.54178","CuKα","","0.0542","0.0384","","","0.0838","0.0909","","","","","","0.995","","","","has coordinates","238284","2020-10-21","18:00:00",""
"1555038","8.3117","0.0002","17.2043","0.0004","8.3018","0.0002","90","","103.231","0.001","90","","1155.62","0.05","130","","130","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H13 N5 O4 -","- C9 H13 N5 O4 -","- C36 H52 N20 O16 -","4","1","","Guo, Xiaowei; Wang, Jidong; Su, Can; Liu, Chongxi; Ma, Xiao-Yan; Yu, Zhiyin; Li, Jiansong; Wang, Xiangjing; Xiang, Wensheng; Huang, Sheng-Xiong","A unique spiro-β-triazinedione-γ-hydantoin type alkaloid with antiviral activity against tobacco mosaic virus from Streptomyces gamaensis","Organic Chemistry Frontiers","2019","6","18","3215","","10.1039/C9QO00742C","","","1.54178","CuKα","","0.0485","0.0477","","","0.1252","0.126","","","","","","0.674","","","","has coordinates","238286","2020-10-21","18:00:00",""
"1555040","9.3448","0.0005","11.2047","0.0008","12.9889","0.0008","106.439","0.006","97.223","0.005","112.631","0.006","1160.92","0.15","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C23 H25 N O9 S -","- C23 H25 N O9 S -","- C46 H50 N2 O18 S2 -","2","1","","Xing, Siyang; Xia, Hanyu; Wang, Xin; Wu, Die; Xu, Xinrui; Su, Yunran; Wang, Kui; Zhu, Bolin; Guo, Junshuo","Diastereoselective access to 2-aminoindanones via the rhodium(ii)-catalyzed tandem reaction involving O‒H insertion and Michael addition","Organic Chemistry Frontiers","2019","6","17","3121","","10.1039/C9QO00765B","","x-ray","0.71073","MoKα","","0.0626","0.0482","","","0.114","0.1288","","","","","","1.061","","","","has coordinates","238288","2020-10-21","18:00:00",""
"1555042","9.1302","0.0003","9.1578","0.0005","10.226","0.0004","108.986","0.004","98.417","0.003","114.037","0.004","698.83","0.07","373","2","373","2","","","","","","","","4","P 1","P 1","1","","","","- C33 H38 N O5 -","- C33 H38 N O5 -","- C33 H38 N O5 -","1","1","","Freeman, Jared L.; Brimble, Margaret A.; Furkert, Daniel P.","A chiral auxiliary-based synthesis of the C5‒C17 trans-decalin framework of anthracimycin","Organic Chemistry Frontiers","2019","6","16","2954","","10.1039/C9QO00769E","","","1.54184","CuKα","","0.0448","0.0436","","","0.1154","0.1169","","","","","","1.054","","","","has coordinates","238290","2020-10-21","18:00:00",""
"1555043","11.9189","0.0004","6.5987","0.0002","26.7335","0.001","90","","100.124","0.004","90","","2069.83","0.12","100","0.1","100","0.1","","","","","","","","3","I 1 2 1","I 2y","5","","","","- C25 H28 O10 -","- C25 H28 O10 -","- C100 H112 O40 -","4","1","","Pan, Dongyan; Zhang, Xuexia; Zheng, Haizhou; Zheng, Zhihui; Nong, Xuhua; Liang, Xiao; Ma, Xuan; Qi, Shuhua","Novel anthraquinone derivatives as inhibitors of protein tyrosine phosphatases and indoleamine 2,3-dioxygenase 1 from the deep-sea derived fungus Alternaria tenuissima DFFSCS013","Organic Chemistry Frontiers","2019","6","18","3252","","10.1039/C9QO00775J","","x-ray","1.54184","CuKα","","0.0344","0.0329","","","0.0901","0.0909","","","","","","1.0239","","","","has coordinates","238291","2020-10-21","18:00:00",""
"1555046","7.7957","0.0007","10.1827","0.0006","12.7574","0.0008","79.033","0.005","76.634","0.007","77.369","0.006","950.96","0.12","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C23 H20 O6 -","- C23 H20 O6 -","- C46 H40 O12 -","2","1","","Li, Qingrui; Yin, Yunnian; Li, Yabo; Zhang, Jianye; Huang, Mengmeng; Kim, Jung Keun; Wu, Yangjie","A simple approach to indeno-coumarins via visible-light-induced cyclization of aryl alkynoates with diethyl bromomalonate","Organic Chemistry Frontiers","2019","6","18","3238","","10.1039/C9QO00795D","","x-ray","0.71073","MoKα","","0.0829","0.053","","","0.1189","0.1395","","","","","","1.026","","","","has coordinates","238294","2020-10-21","18:00:00",""
"1555047","10.0036","0.0011","15.567","0.0013","8.7599","0.0011","90","","100.953","0.011","90","","1339.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 Br O2 -","- C16 H11 Br O2 -","- C64 H44 Br4 O8 -","4","1","","Li, Qingrui; Yin, Yunnian; Li, Yabo; Zhang, Jianye; Huang, Mengmeng; Kim, Jung Keun; Wu, Yangjie","A simple approach to indeno-coumarins via visible-light-induced cyclization of aryl alkynoates with diethyl bromomalonate","Organic Chemistry Frontiers","2019","6","18","3238","","10.1039/C9QO00795D","","x-ray","1.54184","CuKα","","0.0661","0.0403","","","0.0957","0.1132","","","","","","1.025","","","","has coordinates","238294","2020-10-21","18:00:00",""
"1555048","25.676","0.002","4.1792","0.0004","24.335","0.003","90","","112.38","0.014","90","","2414.6","0.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H12 O2 -","- C16 H12 O2 -","- C128 H96 O16 -","8","1","","Li, Qingrui; Yin, Yunnian; Li, Yabo; Zhang, Jianye; Huang, Mengmeng; Kim, Jung Keun; Wu, Yangjie","A simple approach to indeno-coumarins via visible-light-induced cyclization of aryl alkynoates with diethyl bromomalonate","Organic Chemistry Frontiers","2019","6","18","3238","","10.1039/C9QO00795D","","x-ray","0.71073","MoKα","","0.1134","0.0687","","","0.1635","0.2052","","","","","","1.05","","","","has coordinates","238294","2020-10-21","18:00:00",""
"1555049","14.7414","0.0004","8.7416","0.0003","16.409","0.0005","90","","104.242","0.003","90","","2049.53","0.11","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 O6 -","- C23 H22 O6 -","- C92 H88 O24 -","4","1","","Li, Qingrui; Yin, Yunnian; Li, Yabo; Zhang, Jianye; Huang, Mengmeng; Kim, Jung Keun; Wu, Yangjie","A simple approach to indeno-coumarins via visible-light-induced cyclization of aryl alkynoates with diethyl bromomalonate","Organic Chemistry Frontiers","2019","6","18","3238","","10.1039/C9QO00795D","","x-ray","1.54184","CuKα","","0.0794","0.0626","","","0.1809","0.2038","","","","","","1.051","","","","has coordinates","238294","2020-10-21","18:00:00",""
"1555050","14.6483","0.0003","17.4042","0.0004","15.2455","0.0004","90","","94.817","0.002","90","","3872.99","0.16","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H17 Cl O6 -","- C22 H17 Cl O6 -","- C176 H136 Cl8 O48 -","8","2","","Li, Qingrui; Yin, Yunnian; Li, Yabo; Zhang, Jianye; Huang, Mengmeng; Kim, Jung Keun; Wu, Yangjie","A simple approach to indeno-coumarins via visible-light-induced cyclization of aryl alkynoates with diethyl bromomalonate","Organic Chemistry Frontiers","2019","6","18","3238","","10.1039/C9QO00795D","","x-ray","1.54184","CuKα","","0.0746","0.0613","","","0.169","0.1846","","","","","","1.028","","","","has coordinates,has disorder","238294","2020-10-21","18:00:00",""
"1555054","8.8935","0.0001","14.433","0.0001","15.7451","0.0001","90","","92.016","0.001","90","","2019.79","0.03","286","5","286","5","","","","","","","fungus","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H22 O10 -","- C21 H22 O10 -","- C84 H88 O40 -","4","1","","Zang, Yi; Gong, Yi-Hua; Li, Xu-Wen; Li, Xiao-Nian; Liu, Jun-Jun; Chen, Chun-Mei; Zhou, Yuan; Gu, Liang-Hu; Luo, Zeng-Wei; Wang, Jian-Ping; Sun, Wei-Guang; Zhu, Hu-Cheng; Zhang, Yong-Hui","Canescones A‒E: aromatic polyketide dimers with PTP1B inhibitory activity from Penicillium canescens","Organic Chemistry Frontiers","2019","6","18","3274","","10.1039/C9QO00820A","","x-ray","1.54184","CuKα","","0.0425","0.0413","","","0.1123","0.1134","","","","","","1.083","","","","has coordinates,has disorder","238298","2020-10-21","18:00:00",""
"1555055","9.016","0.0002","9.3778","0.0002","10.636","0.0002","93.717","0.002","90.826","0.002","92.317","0.002","896.52","0.03","100.01","0.1","100.01","0.1","","","","","","","fungus","3","P -1","-P 1","2","","","","- C20 H20 O10 -","- C20 H20 O10 -","- C40 H40 O20 -","2","1","","Zang, Yi; Gong, Yi-Hua; Li, Xu-Wen; Li, Xiao-Nian; Liu, Jun-Jun; Chen, Chun-Mei; Zhou, Yuan; Gu, Liang-Hu; Luo, Zeng-Wei; Wang, Jian-Ping; Sun, Wei-Guang; Zhu, Hu-Cheng; Zhang, Yong-Hui","Canescones A‒E: aromatic polyketide dimers with PTP1B inhibitory activity from Penicillium canescens","Organic Chemistry Frontiers","2019","6","18","3274","","10.1039/C9QO00820A","","x-ray","1.54184","CuKα","","0.0357","0.0326","","","0.0822","0.084","","","","","","1.05","","","","has coordinates","238298","2020-10-21","18:00:00",""
"1555056","8.33914","0.00003","13.29606","0.00005","18.06836","0.00008","90","","90","","90","","2003.38","0.014","100","0.1","100","0.1","","","","","","","fungus","3","P c a 21","P 2c -2ac","29","","","","- C21 H22 O11 -","- C21 H22 O11 -","- C84 H88 O44 -","4","1","","Zang, Yi; Gong, Yi-Hua; Li, Xu-Wen; Li, Xiao-Nian; Liu, Jun-Jun; Chen, Chun-Mei; Zhou, Yuan; Gu, Liang-Hu; Luo, Zeng-Wei; Wang, Jian-Ping; Sun, Wei-Guang; Zhu, Hu-Cheng; Zhang, Yong-Hui","Canescones A‒E: aromatic polyketide dimers with PTP1B inhibitory activity from Penicillium canescens","Organic Chemistry Frontiers","2019","6","18","3274","","10.1039/C9QO00820A","","x-ray","1.54184","CuKα","","0.0219","0.0218","","","0.0559","0.0559","","","","","","1.067","","","","has coordinates","238298","2020-10-21","18:00:00",""
"1555057","8.2302","0.0004","14.4554","0.0006","16.2394","0.0007","90","","90","","90","","1932.01","0.15","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H22 O11 -","- C21 H22 O11 -","- C84 H88 O44 -","4","1","","Zang, Yi; Gong, Yi-Hua; Li, Xu-Wen; Li, Xiao-Nian; Liu, Jun-Jun; Chen, Chun-Mei; Zhou, Yuan; Gu, Liang-Hu; Luo, Zeng-Wei; Wang, Jian-Ping; Sun, Wei-Guang; Zhu, Hu-Cheng; Zhang, Yong-Hui","Canescones A‒E: aromatic polyketide dimers with PTP1B inhibitory activity from Penicillium canescens","Organic Chemistry Frontiers","2019","6","18","3274","","10.1039/C9QO00820A","","","1.54178","CuKα","","0.04","0.0382","","","0.116","0.1193","","","","","","1.019","","","","has coordinates","238298","2020-10-21","18:00:00",""
"1555058","8.26703","0.00005","13.79202","0.00008","17.73644","0.0001","90","","102.392","0.0006","90","","1975.18","0.02","99.99","0.1","99.99","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H23 N O9 -","- C22 H23 N O9 -","- C88 H92 N4 O36 -","4","1","","Zang, Yi; Gong, Yi-Hua; Li, Xu-Wen; Li, Xiao-Nian; Liu, Jun-Jun; Chen, Chun-Mei; Zhou, Yuan; Gu, Liang-Hu; Luo, Zeng-Wei; Wang, Jian-Ping; Sun, Wei-Guang; Zhu, Hu-Cheng; Zhang, Yong-Hui","Canescones A‒E: aromatic polyketide dimers with PTP1B inhibitory activity from Penicillium canescens","Organic Chemistry Frontiers","2019","6","18","3274","","10.1039/C9QO00820A","","x-ray","1.54184","CuKα","","0.0351","0.0331","","","0.0899","0.0913","","","","","","1.065","","","","has coordinates","238298","2020-10-21","18:00:00",""
"1555062","10.7304","0.0004","18.6098","0.0005","9.9301","0.0004","90","","115.595","0.004","90","","1788.36","0.12","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H19 F3 -","- C23 H19 F3 -","- C92 H76 F12 -","4","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.0447","0.0395","","","0.1059","0.1107","","","","","","1.041","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555063","9.28774","0.00013","13.98378","0.00018","16.25245","0.00018","94.589","0.001","106.279","0.0011","98.2135","0.0011","1989.34","0.05","100","5","100","5","","","","","","","","4","P -1","-P 1","2","","","","- C24 H21 F3 O2 -","- C24 H21 F3 O2 -","- C96 H84 F12 O8 -","4","2","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.0393","0.0384","","","0.0955","0.0962","","","","","","1.034","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555064","8.7646","0.0001","10.6788","0.0002","20.8962","0.0003","90","","94.821","0.001","90","","1948.87","0.05","100","3","100","3","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 F4 O2 -","- C24 H20 F4 O2 -","- C96 H80 F16 O8 -","4","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.0406","0.0367","","","0.0976","0.101","","","","","","1.077","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555065","9.7671","0.0005","10.3099","0.0004","19.8876","0.0007","92.41","0.003","96.248","0.004","107.45","0.004","1893.23","0.15","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H21 F3 -","- C24 H21 F3 -","- C96 H84 F12 -","4","2","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","","0.71073","MoKα","","0.0722","0.0529","","","0.1186","0.1314","","","","","","1.028","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555066","8.8501","0.0009","10.1181","0.0012","11.7209","0.001","98.214","0.009","105.322","0.009","103.258","0.009","961.85","0.19","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H21 F3 O2 -","- C24 H21 F3 O2 -","- C48 H42 F6 O4 -","2","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.1198","0.0868","","","0.2319","0.2604","","","","","","1.028","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555067","9.9918","0.0002","10.2089","0.0002","10.5751","0.0002","91.174","0.002","116.274","0.002","107.926","0.002","904.65","0.04","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H19 F3 O -","- C23 H19 F3 O -","- C46 H38 F6 O2 -","2","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.0344","0.033","","","0.0884","0.0897","","","","","","1.058","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555068","8.9463","0.0003","10.2875","0.0003","11.0964","0.0003","70.184","0.002","86.437","0.002","76.947","0.002","935.84","0.05","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H21 F3 -","- C24 H21 F3 -","- C48 H42 F6 -","2","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.0536","0.0464","","","0.1316","0.1375","","","","","","1.072","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555069","9.0216","0.0004","9.9831","0.0004","11.9107","0.0005","77.527","0.004","82.086","0.004","74.544","0.004","1005.86","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H20 Cl F3 O2 -","- C24 H20 Cl F3 O2 -","- C48 H40 Cl2 F6 O4 -","2","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.0419","0.0388","","","0.0981","0.1008","","","","","","1.052","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555070","10.5544","0.0004","15.4584","0.0006","12.2743","0.0004","90","","102.702","0.004","90","","1953.59","0.13","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H23 F3 -","- C25 H23 F3 -","- C100 H92 F12 -","4","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","","0.71073","MoKα","","0.0489","0.0398","","","0.0928","0.0984","","","","","","1.032","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555071","11.6641","0.0003","9.1396","0.0002","17.3076","0.0004","90","","95.883","0.002","90","","1835.36","0.08","100","3","100","3","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 F3 -","- C24 H21 F3 -","- C96 H84 F12 -","4","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.0429","0.0377","","","0.1012","0.1051","","","","","","1.055","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555072","9.02917","0.0002","9.25385","0.00019","11.1048","0.0002","87.5911","0.0016","80.5904","0.0018","78.3143","0.0018","896.36","0.03","100","3","100","3","","","","","","","","4","P -1","-P 1","2","","","","- C22 H16 Br F3 -","- C22 H16 Br F3 -","- C44 H32 Br2 F6 -","2","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.0267","0.0247","","","0.0604","0.0615","","","","","","1.058","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555073","9.2224","0.0005","10.2968","0.0005","11.9735","0.0005","74.791","0.004","80.463","0.004","72.449","0.005","1041.48","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H19 Cl2 F3 O2 -","- C24 H19 Cl2 F3 O2 -","- C48 H38 Cl4 F6 O4 -","2","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.055","0.0484","","","0.1495","0.1574","","","","","","1.059","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555074","21.8668","0.0005","10.36934","0.00016","18.0539","0.0004","90","","113.947","0.003","90","","3741.25","0.16","100","2","100","2","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","","- C22 H15 Cl2 F3 -","- C22 H15 Cl2 F3 -","- C176 H120 Cl16 F24 -","8","1","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","","0.71073","MoKα","","0.0502","0.0428","","","0.102","0.1068","","","","","","1.03","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555075","10.1714","0.0003","36.8462","0.001","10.1929","0.0003","90","","103.732","0.003","90","","3710.88","0.19","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H21 F3 -","- C24 H21 F3 -","- C192 H168 F24 -","8","2","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.0618","0.0545","","","0.1489","0.1543","","","","","","1.033","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555076","11.5733","0.0002","18.729","0.0004","19.4741","0.0004","90","","105.635","0.002","90","","4064.94","0.14","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H23 F3 O2 -","- C25 H23 F3 O2 -","- C200 H184 F24 O16 -","8","2","","Zerov, Aleksey V.; Bulova, Anastasia A.; Khoroshilova, Olesya V.; Vasilyev, Aleksander V.","TfOH-promoted transformation of TMS-ethers of diarylsubstituted CF3-allyl alcohols with arenes into CF3-indanes","Organic Chemistry Frontiers","2019","6","18","3264","","10.1039/C9QO00822E","","x-ray","1.54184","CuKα","","0.0398","0.0354","","","0.0901","0.0928","","","","","","1.052","","","","has coordinates","238302","2020-10-21","18:00:00",""
"1555079","14.099","0.002","5.2916","0.0009","9.1495","0.0016","90","","101.496","0.007","90","","668.92","0.19","273","2","273","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C16 H13 N O3 -","- C16 H13 N O3 -","- C32 H26 N2 O6 -","2","1","","He, Guangke; Li, Yuan; Yu, Zilun; Chen, Zhaoqiang; Tang, Yongming; Song, Guangliang; Loh, Teck-Peng","Selectfluor™-catalyzed oxidative cyclization of ynamides enables facile synthesis of oxazolidine-2,4-diones","Organic Chemistry Frontiers","2019","6","21","3644","","10.1039/C9QO00845D","","","0.71073","MoKα","","0.0506","0.041","","","0.1183","0.1268","","","","","","1.067","","","","has coordinates,has disorder","238305","2020-10-21","18:00:00",""
"1555081","4.12","0.0005","14.2279","0.0012","26.763","0.002","90","","94.268","0.008","90","","1564.5","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H12 I N3 S -","- C17 H12 I N3 S -","- C68 H48 I4 N12 S4 -","4","1","","Zhou, Yao; Lou, Yixian; Wang, Ya; Song, Qiuling","Oxidant-controlled divergent transformations of 3-aminoindazoles for the synthesis of pyrimido[1,2-b]-indazoles and aromatic nitrile-derived dithioacetals","Organic Chemistry Frontiers","2019","6","19","3355","","10.1039/C9QO00847K","","","0.71073","MoKα","","0.0518","0.0463","","","0.0962","0.0989","","","","","","1.124","","","","has coordinates","238307","2020-10-21","18:00:00",""
"1555082","10.1327","0.001","12.0719","0.0014","28.967","0.003","90","","90","","90","","3543.3","0.7","298","","298","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C9.5 H8.5 N0.5 O0.5 S -","- C9.5 H8.5 N0.5 O0.5 S -","- C152 H136 N8 O8 S16 -","16","2","","Zhou, Yao; Lou, Yixian; Wang, Ya; Song, Qiuling","Oxidant-controlled divergent transformations of 3-aminoindazoles for the synthesis of pyrimido[1,2-b]-indazoles and aromatic nitrile-derived dithioacetals","Organic Chemistry Frontiers","2019","6","19","3355","","10.1039/C9QO00847K","","x-ray","0.71073","MoKα","","0.1198","0.0634","","","0.1463","0.1848","","","","","","0.8505","","","","has coordinates","238307","2020-10-21","18:00:00",""
"1555084","6.1329","0.0008","40.065","0.005","10.6098","0.0015","90","","103.811","0.004","90","","2531.6","0.6","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H16 F9 N O4 -","- C26 H16 F9 N O4 -","- C104 H64 F36 N4 O16 -","4","1","","He, Wei; Yu, Jipan; Wang, Dawei; Ran, Guoxia; Xia, Xiao-Feng","Synthesis of tri-substituted allyl alcohols via a copper/iron co-catalyzed cascade perfluoroalkylation/rearrangement of aryl propynyl ethers","Organic Chemistry Frontiers","2019","6","20","3575","","10.1039/C9QO00848A","","","0.71073","MoKα","","0.195","0.0971","","","0.2449","0.304","","","","","","1.026","","","","has coordinates","238309","2020-10-21","18:00:00",""
"1555085","11.543","0.005","10.4","0.002","32.618","0.006","90","","90","","90","","3916","2","300","2","300.09","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C3.38 H1.96 Cl0.18 F1.6 N0 O0.18 -","- C3.37778 H1.77778 Cl0.177778 F1.6 O0.177778 -","- C152 H80 Cl8 F72 O8 -","45","11.25","","He, Wei; Yu, Jipan; Wang, Dawei; Ran, Guoxia; Xia, Xiao-Feng","Synthesis of tri-substituted allyl alcohols via a copper/iron co-catalyzed cascade perfluoroalkylation/rearrangement of aryl propynyl ethers","Organic Chemistry Frontiers","2019","6","20","3575","","10.1039/C9QO00848A","","","1.54178","CuKα","","0.0854","0.0712","","","0.2132","0.2395","","","","","","1.065","","","","has coordinates","238309","2020-10-21","18:00:00",""
"1555087","7.1385","0.0009","7.5039","0.001","19.126","0.003","90","","90","","90","","1024.5","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C2 H1.8 F0.6 N0.4 O0.2 -","- C2 H1.8 F0.6 N0.4 O0.2 -","- C40 H36 F12 N8 O4 -","20","5","","Wang, Xiaonan; Gao, Yuan; Wei, Zhonglin; Cao, Jungang; Liang, Dapeng; Lin, Yingjie; Duan, Haifeng","An enantioselective aza-Henry reaction of trifluoromethyl ketimines catalyzed by phase-transfer catalysts","Organic Chemistry Frontiers","2019","6","18","3269","","10.1039/C9QO00850K","","","0.71073","MoKα","","0.0883","0.0458","","","0.0892","0.1034","","","","","","0.933","","","","has coordinates","238311","2020-10-21","18:00:00",""
"1555088","7.2179","0.001","17.509","0.002","18.867","0.003","90","","100.172","0.008","90","","2346.9","0.6","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C26 H20 Cl F3 N2 O2 -","- C26 H20 Cl F3 N2 O2 -","- C104 H80 Cl4 F12 N8 O8 -","4","1","","Yu, Yang; Zhang, Yan; Wang, Zhuo; Liang, Yong-Xin; Zhao, Yu-Long","A rhodium-catalyzed three-component reaction of arylisocyanides, trifluorodiazoethane, and activated methylene isocyanides or azomethine ylides: an efficient synthesis of trifluoroethyl-substituted imidazoles","Organic Chemistry Frontiers","2019","6","21","3657","","10.1039/C9QO00856J","","","1.54178","CuKα","","0.0619","0.042","","","0.0952","0.1026","","","","","","1.091","","","","has coordinates","238312","2020-10-21","18:00:00",""
"1555092","10.1647","0.0009","17.2468","0.0015","20.8692","0.0018","90","","101.136","0.002","90","","3589.7","0.5","150","2","150.15","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C46 H40 O8 -","- C46 H40 O8 -","- C184 H160 O32 -","4","1","","Bolshchikov, Boris; Volkov, Sergey; Sokolova, Daria; Gorbunov, Alexander; Serebryannikova, Alina; Gloriozov, Igor; Cheshkov, Dmitry; Bezzubov, Stanislav; Chung, Wen-Sheng; Kovalev, Vladimir; Vatsouro, Ivan","Constructing bridged multifunctional calixarenes by intramolecular indole coupling","Organic Chemistry Frontiers","2019","6","19","3327","","10.1039/C9QO00859D","","x-ray","0.71073","MoKα","","0.0665","0.0432","","","0.0905","0.1004","","","","","","1.02","","","","has coordinates","238316","2020-10-21","18:00:00",""
"1555093","16.5782","0.0011","28.2895","0.0019","17.3002","0.0011","90","","93.414","0.002","90","","8099.2","0.9","150","2","150.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C72 H64 N10 O6 -","- C72 H64 N10 O6 -","- C288 H256 N40 O24 -","4","1","","Bolshchikov, Boris; Volkov, Sergey; Sokolova, Daria; Gorbunov, Alexander; Serebryannikova, Alina; Gloriozov, Igor; Cheshkov, Dmitry; Bezzubov, Stanislav; Chung, Wen-Sheng; Kovalev, Vladimir; Vatsouro, Ivan","Constructing bridged multifunctional calixarenes by intramolecular indole coupling","Organic Chemistry Frontiers","2019","6","19","3327","","10.1039/C9QO00859D","","","0.71073","MoKα","","0.2255","0.1582","","","0.4204","0.4539","","","","","","1.472","","","","has coordinates,has disorder","238316","2020-10-21","18:00:00",""
"1555094","30.104","0.003","23.487","0.002","26.09","0.004","90","","121.557","0.001","90","","15719","3","150","2","150.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C76 H68 N8 O8 -","- C76 H68.052 N8.052 O8 -","- C608 H544.416 N64.416 O64 -","8","1","","Bolshchikov, Boris; Volkov, Sergey; Sokolova, Daria; Gorbunov, Alexander; Serebryannikova, Alina; Gloriozov, Igor; Cheshkov, Dmitry; Bezzubov, Stanislav; Chung, Wen-Sheng; Kovalev, Vladimir; Vatsouro, Ivan","Constructing bridged multifunctional calixarenes by intramolecular indole coupling","Organic Chemistry Frontiers","2019","6","19","3327","","10.1039/C9QO00859D","","","0.71073","MoKα","","0.2181","0.164","","","0.3643","0.3949","","","","","","1.034","","","","has coordinates,has disorder","238316","2020-10-21","18:00:00",""
"1555097","14.445","0.0009","6.6377","0.0003","15.6545","0.0006","90","","94.414","0.005","90","","1496.53","0.13","297.4","0.6","297.4","0.6","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H9.33 Cl0.67 N2 -","- C12 H9.33333 Cl0.666667 N2 -","- C72 H56 Cl4 N12 -","6","1.5","","Surendra Reddy, G.; Ramachary, Dhevalapally B.","Reaction engineering and photophysical studies of fully enriched C-vinyl-1,2,3-triazoles","Organic Chemistry Frontiers","2019","6","21","3620","","10.1039/C9QO00864K","","x-ray","0.71073","MoKα","","0.1144","0.0775","","","0.2213","0.2595","","","","","","1.046","","","","has coordinates","238319","2020-10-21","18:00:00",""
"1555098","13.055","0.005","13.601","0.005","10.697","0.005","90","0.005","100.788","0.005","90","0.005","1865.8","1.3","293","2","293","2","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C23 H16 N4 -","- C23 H16 N4 -","- C92 H64 N16 -","4","1","","Surendra Reddy, G.; Ramachary, Dhevalapally B.","Reaction engineering and photophysical studies of fully enriched C-vinyl-1,2,3-triazoles","Organic Chemistry Frontiers","2019","6","21","3620","","10.1039/C9QO00864K","","","0.71073","MoKα","","0.077","0.0668","","","0.1683","0.1755","","","","","","1.071","","","","has coordinates","277994","2022-09-20","08:32:41",""
"1555099","9.293","0.005","13.946","0.005","16.068","0.005","114.567","0.005","99.86","0.005","93.392","0.005","1846.1","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H14 F N3 O2 -","- C23 H14 F N3 O2 -","- C92 H56 F4 N12 O8 -","4","2","","Surendra Reddy, G.; Ramachary, Dhevalapally B.","Reaction engineering and photophysical studies of fully enriched C-vinyl-1,2,3-triazoles","Organic Chemistry Frontiers","2019","6","21","3620","","10.1039/C9QO00864K","","","0.71073","MoKα","","0.0733","0.0461","","","0.1047","0.1164","","","","","","1.057","","","","has coordinates","273808","2022-03-18","10:32:15",""
"1555101","8.9187","0.0005","14.6101","0.0009","16.5218","0.0009","90","","90","","90","","2152.8","0.2","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","BM6","","- C25 H22 F N O5 -","- C25 H22 F N O5 -","- C100 H88 F4 N4 O20 -","4","1","","Bhattacharya, Aditya; mani Shukla, Pushpendra; Kumar Kaushik, Lalit; Maji, Biswajit","Synthesis of chromans and kinetic resolution of 2-aryl-3-nitro-2H-chromenes via the NHC-bound azolium homoenolate pathway","Organic Chemistry Frontiers","2019","6","20","3523","","10.1039/C9QO00868C","","x-ray","0.71073","MoKα","","0.0976","0.0578","","","0.1202","0.1502","","","","","","1.072","","","","has coordinates","238322","2020-10-21","18:00:00",""
"1555103","19.5977","0.0012","8.1238","0.0004","23.2996","0.0012","90","","90.182","0.005","90","","3709.5","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H21 N O3 S -","- C22 H21 N O3 S -","- C176 H168 N8 O24 S8 -","8","1","","Chen, Xiaoyan; Zhou, Hao; Chen, Zhiyuan","Pd/P/dba-Promoted cascade annulations to produce fused medium-sized sulfoximine polyheterocycles","Organic Chemistry Frontiers","2019","6","19","3415","","10.1039/C9QO00880B","","","0.71073","MoKα","","0.0458","0.0412","","","0.1085","0.1121","","","","","","1.007","","","","has coordinates","238324","2020-10-21","18:00:00",""
"1555104","8.199","0.0007","11.3055","0.0013","14.2419","0.0011","100.441","0.008","100.282","0.007","91.136","0.008","1275.6","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H22 Br3 Cl2 N O3 S -","- C23 H22 Br3 Cl2 N O3 S -","- C46 H44 Br6 Cl4 N2 O6 S2 -","2","1","","Chen, Xiaoyan; Zhou, Hao; Chen, Zhiyuan","Pd/P/dba-Promoted cascade annulations to produce fused medium-sized sulfoximine polyheterocycles","Organic Chemistry Frontiers","2019","6","19","3415","","10.1039/C9QO00880B","","","0.71073","MoKα","","0.2451","0.1666","","","0.2851","0.3351","","","","","","1.094","","","","has coordinates","238324","2020-10-21","18:00:00",""
"1555110","7.9759","0.0004","16.1628","0.0008","31.7213","0.0015","90","","90","","90","","4089.3","0.3","120","2","120","2","","","","","","","synthesized by the authors","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H20 O3 S -","- C26 H20 O3 S -","- C208 H160 O24 S8 -","8","2","","Dočekal, Vojtěch; Formánek, Bedřich; Císařová, Ivana; Veselý, Jan","A formal [4 + 2] cycloaddition of sulfur-containing alkylidene heterocycles with allenic compounds","Organic Chemistry Frontiers","2019","6","18","3259","","10.1039/C9QO00886A","","","0.71073","MoKα","","0.0458","0.0383","","","0.0854","0.089","","","","","","1.086","","","","has coordinates","238326","2020-10-21","18:00:00",""
"1555111","5.7472","0.0002","16.912","0.0006","22.0104","0.0008","90","","90","","90","","2139.34","0.13","120","2","120","2","","","","","","","synthesized by the authors","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H21 N O3 S -","- C27 H21 N O3 S -","- C108 H84 N4 O12 S4 -","4","1","","Dočekal, Vojtěch; Formánek, Bedřich; Císařová, Ivana; Veselý, Jan","A formal [4 + 2] cycloaddition of sulfur-containing alkylidene heterocycles with allenic compounds","Organic Chemistry Frontiers","2019","6","18","3259","","10.1039/C9QO00886A","","","1.54178","CuKα","","0.0265","0.0255","","","0.0627","0.0633","","","","","","1.075","","","","has coordinates","238326","2020-10-21","18:00:00",""
"1555113","10.596","0.0005","11.6796","0.0005","12.6988","0.0006","69.855","0.004","70.549","0.004","88.791","0.004","1383.42","0.12","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C33 H25 Cl N2 O5 -","- C33 H25 Cl N2 O5 -","- C66 H50 Cl2 N4 O10 -","2","2","","Wang, Zhen-Hua; Lei, Chuan-Wen; Zhang, Xia-Yan; You, Yong; Zhao, Jian-Qiang; Yuan, Wei-Cheng","Asymmetric domino 1,6-addition/annulation reaction of 3-cyano-4-alkenyl-2H-chromen-2-ones with isatin-derived MBH carbonates: enantioselective synthesis of 3,3′-cyclopentenylspirooxindoles bearing 2H-chromen-2-ones","Organic Chemistry Frontiers","2019","6","19","3342","","10.1039/C9QO00890J","","x-ray","1.54184","CuKα","","0.0499","0.0449","","","0.1108","0.1165","","","","","","1.051","","","","has coordinates","238328","2020-10-21","18:00:00",""
"1555115","17.7343","0.0017","13.4538","0.0011","24.68","0.002","90","","94.67","0.003","90","","5868.9","0.9","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H29 Cl N2 O3 -","- C33 H29 Cl N2 O3 -","- C264 H232 Cl8 N16 O24 -","8","2","","Wu, Wen-Tao; Han, Ying; Sun, Jing; Yan, Chao-Guo","Efficient construction of pyrrolo[1′,2′:1,2]azocino[4,5-c]quinolines via cascade cycloaddition and annulation reaction","Organic Chemistry Frontiers","2019","6","20","3530","","10.1039/C9QO00891H","","","0.71073","MoKα","","0.1516","0.0662","","","0.1679","0.2067","","","","","","1.016","","","","has coordinates","238330","2020-10-21","18:00:00",""
"1555116","9.853","0.0014","14.0452","0.0018","15.201","0.002","111.663","0.004","93.543","0.005","102.84","0.004","1882","0.4","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H39 N3 O7 -","- C44 H39 N3 O7 -","- C88 H78 N6 O14 -","2","1","","Wu, Wen-Tao; Han, Ying; Sun, Jing; Yan, Chao-Guo","Efficient construction of pyrrolo[1′,2′:1,2]azocino[4,5-c]quinolines via cascade cycloaddition and annulation reaction","Organic Chemistry Frontiers","2019","6","20","3530","","10.1039/C9QO00891H","","","0.71073","MoKα","","0.1855","0.0718","","","0.1451","0.1845","","","","","","1.006","","","","has coordinates","238330","2020-10-21","18:00:00",""
"1555117","12.847","0.003","12.739","0.003","20.208","0.004","90","","96.73","0.006","90","","3284.4","1.3","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H29 N3 O5 -","- C33 H29 N3 O5 -","- C132 H116 N12 O20 -","4","1","","Wu, Wen-Tao; Han, Ying; Sun, Jing; Yan, Chao-Guo","Efficient construction of pyrrolo[1′,2′:1,2]azocino[4,5-c]quinolines via cascade cycloaddition and annulation reaction","Organic Chemistry Frontiers","2019","6","20","3530","","10.1039/C9QO00891H","","","0.71073","MoKα","","0.1512","0.0833","","","0.2481","0.2858","","","","","","1.046","","","","has coordinates","238330","2020-10-21","18:00:00",""
"1555118","10.1992","0.001","17.1094","0.0019","33.448","0.003","90","","90","","90","","5836.7","1","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C34 H28 Cl2 N2 O3 -","- C34 H28 Cl2 N2 O3 -","- C272 H224 Cl16 N16 O24 -","8","1","","Wu, Wen-Tao; Han, Ying; Sun, Jing; Yan, Chao-Guo","Efficient construction of pyrrolo[1′,2′:1,2]azocino[4,5-c]quinolines via cascade cycloaddition and annulation reaction","Organic Chemistry Frontiers","2019","6","20","3530","","10.1039/C9QO00891H","","","0.71073","MoKα","","0.1643","0.0727","","","0.1324","0.1624","","","","","","1.052","","","","has coordinates","238330","2020-10-21","18:00:00",""
"1555120","9.2786","0.0006","9.5213","0.0006","15.4265","0.0006","75.673","0.004","76.438","0.004","71.3","0.005","1232.75","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H40 N3 O5 P -","- C20 H40 N3 O5 P -","- C40 H80 N6 O10 P2 -","2","1","","Audran, Gérard; Bosco, Lionel; Brémond, Paul; Jugniot, Natacha; Marque, Sylvain R. A.; Massot, Philippe; Mellet, Philippe; Moussounda Moussounda Koumba, Tataye; Parzy, Elodie; Rivot, Angélique; Thiaudière, Eric; Voisin, Pierre; Wedl, Carina; Yamasaki, Toshihide","Enzymatic triggering of C–ON bond homolysis of alkoxyamines","Organic Chemistry Frontiers","2019","6","21","3663","","10.1039/C9QO00899C","","x-ray","1.54184","CuKα","","0.0601","0.0522","","","0.1447","0.1561","","","","","","1.053","","","","has coordinates","288248","2023-12-12","12:55:27",""
"1555121","8.8282","0.0006","22.0666","0.0014","12.5309","0.0006","90","","96.936","0.005","90","","2423.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H38 N3 O4 P -","- C20 H38 N3 O4 P -","- C80 H152 N12 O16 P4 -","4","1","","Audran, Gérard; Bosco, Lionel; Brémond, Paul; Jugniot, Natacha; Marque, Sylvain R. A.; Massot, Philippe; Mellet, Philippe; Moussounda Moussounda Koumba, Tataye; Parzy, Elodie; Rivot, Angélique; Thiaudière, Eric; Voisin, Pierre; Wedl, Carina; Yamasaki, Toshihide","Enzymatic triggering of C–ON bond homolysis of alkoxyamines","Organic Chemistry Frontiers","2019","6","21","3663","","10.1039/C9QO00899C","","x-ray","1.54184","CuKα","","0.0584","0.0477","","","0.1301","0.143","","","","","","1.04","","","","has coordinates","288248","2023-12-12","12:55:27",""
"1555123","10.22","0.002","9.55","0.002","20.071","0.005","90","","93.737","0.013","90","","1954.8","0.7","273","2","273.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H24 O -","- C25 H24 O -","- C100 H96 O4 -","4","1","","Li, Hexin; Zhang, Mengru; Mehfooz, Haroon; Zhu, Dongxia; Zhao, Jinbo; Zhang, Qian","Highly convergent modular access to poly-carbon substituted cyclopropanes via Cu(i)-catalyzed three-component cyclopropene carboallylation","Organic Chemistry Frontiers","2019","6","19","3387","","10.1039/C9QO00902G","","","1.54178","CuKα","","0.0749","0.0624","","","0.1446","0.153","","","","","","1.081","","","","has coordinates","238334","2020-10-21","18:00:00",""
"1555125","13.3229","0.0003","6.2024","0.0001","15.4655","0.0004","90","","115.145","0.003","90","","1156.87","0.05","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C22 H18 Br Cl3 N2 O4 -","- C22 H18 Br Cl3 N2 O4 -","- C44 H36 Br2 Cl6 N4 O8 -","2","1","","Zhao, Mei-Xin; Liu, Qiang; Yu, Kun-Ming; Zhao, Xiao-Li; Shi, Min","Organocatalyzed asymmetric formal [3 + 2] cycloaddition of isocyanoacetates with N-itaconimides: facile access to optically active spiropyrroline succinimide derivatives","Organic Chemistry Frontiers","2019","6","23","3879","","10.1039/C9QO00939F","","x-ray","1.54184","CuKα","","0.0443","0.0424","","","0.1096","0.1112","","","","","","1.093","","","","has coordinates","238336","2020-10-21","18:00:00",""
"1555127","5.0942","0.0009","9.6532","0.0013","11.935","0.002","91.045","0.013","91.275","0.014","101.201","0.013","575.43","0.16","293.6","0.3","293.6","0.3","","","","","","","","5","P -1","-P 1","2","","","","- C13 H10 F3 N O -","- C13 H10 F3 N O -","- C26 H20 F6 N2 O2 -","2","1","","Lu, Kui; Wei, Xianfu; Li, Quan; Li, Yuxuan; Ji, Liangshuo; Hua, Erbing; Dai, Yujie; Zhao, Xia","Synthesis of α-trifluoromethyl ethanone oximes via the three-component reaction of aryl-substituted ethylenes, tert-butyl nitrite, and the Langlois reagent","Organic Chemistry Frontiers","2019","6","22","3766","","10.1039/C9QO00940J","","x-ray","0.71073","MoKα","","0.1682","0.0938","","","0.2251","0.2822","","","","","","1.005","","","","has coordinates","238338","2020-10-21","18:00:00",""
"1555129","7.0302","0.0007","7.6119","0.0008","7.7844","0.0009","94.191","0.009","109.731","0.01","97.56","0.009","385.61","0.08","293","2","293","2","","","","","","","","3","P 1","P 1","1","","","","- C7.5 H15 O2 -","- C7.5 H15 O2 -","- C15 H30 O4 -","2","2","","Song, Yin-Ping; Miao, Feng-Ping; Yin, Xiu-Li; Ji, Nai-Yun","Nitrogenous cyclonerane sesquiterpenes from an algicolous strain of Trichoderma asperellum","Organic Chemistry Frontiers","2019","6","21","3698","","10.1039/C9QO00942F","","","1.54178","CuKα","","0.0322","0.0315","","","0.0858","0.0865","","","","","","1.092","","","","has coordinates","238340","2020-10-21","18:00:00",""
"1555131","5.168","0.0004","15.6589","0.0007","15.9344","0.0011","90","","90","","90","","1289.49","0.15","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H9 N3 O2 S -","- C16 H9 N3 O2 S -","- C64 H36 N12 O8 S4 -","4","1","","Recio, Javier; Pérez-Redondo, Adrián; Alvarez-Builla, Julio; Burgos, Carolina","Access to 2-substituted 1-pyridin-3-yl-β-carboline derivatives by intramolecular radical cyclization-ring opening-SNAr substitution","Organic Chemistry Frontiers","2019","6","18","3300","","10.1039/C9QO00944B","","x-ray","0.71073","MoKα","","0.0688","0.0445","","","0.0842","0.0938","","","","","","1.087","","","","has coordinates","238342","2020-10-21","18:00:00",""
"1555132","8.3252","0.0006","9.8395","0.0012","11.1869","0.0013","65.08","0.009","71.705","0.009","67.231","0.006","753.73","0.15","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H10 Br N3 O2 S -","- C16 H10 Br N3 O2 S -","- C32 H20 Br2 N6 O4 S2 -","2","1","","Recio, Javier; Pérez-Redondo, Adrián; Alvarez-Builla, Julio; Burgos, Carolina","Access to 2-substituted 1-pyridin-3-yl-β-carboline derivatives by intramolecular radical cyclization-ring opening-SNAr substitution","Organic Chemistry Frontiers","2019","6","18","3300","","10.1039/C9QO00944B","","x-ray","0.71073","MoKα","","0.047","0.036","","","0.082","0.0882","","","","","","1.087","","","","has coordinates","238342","2020-10-21","18:00:00",""
"1555136","7.8518","0.0006","10.3592","0.0007","14.2099","0.0011","80.043","0.002","83.223","0.002","82.438","0.002","1123.12","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H25 N O3 S -","- C27 H25 N O3 S -","- C54 H50 N2 O6 S2 -","2","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.0961","0.0492","","","0.11","0.1265","","","","","","1.018","","","","has coordinates,has disorder","238346","2020-10-21","18:00:00",""
"1555137","5.9034","0.0005","21.165","0.002","21.6677","0.0019","90","","91.308","0.003","90","","2706.6","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 Cl N O3 S -","- C26 H22 Cl N O3 S -","- C104 H88 Cl4 N4 O12 S4 -","4","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.1789","0.0779","","","0.1912","0.2261","","","","","","1.035","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555138","9.3704","0.0005","10.2251","0.0006","11.2595","0.0006","76.2532","0.0018","78.5679","0.0016","75.2513","0.0017","1002.43","0.1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H18 Cl N O3 S -","- C24 H18 Cl N O3 S -","- C48 H36 Cl2 N2 O6 S2 -","2","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.0459","0.038","","","0.0971","0.1024","","","","","","1.021","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555139","7.8538","0.0006","13.4956","0.001","17.2047","0.0016","90","","101.145","0.003","90","","1789.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H17 N O4 S -","- C23 H17 N O4 S -","- C92 H68 N4 O16 S4 -","4","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.0785","0.0505","","","0.1115","0.1231","","","","","","1.048","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555140","13.0035","0.0011","15.8463","0.0012","9.5395","0.0009","90","","101.719","0.003","90","","1924.7","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H16 N2 O5 S -","- C23 H16 N2 O5 S -","- C92 H64 N8 O20 S4 -","4","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.0768","0.047","","","0.104","0.1169","","","","","","1.02","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555141","7.3838","0.0011","11.2551","0.0015","24.298","0.003","90","","90","","90","","2019.3","0.5","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H21 N O3 S -","- C24 H21 N O3 S -","- C96 H84 N4 O12 S4 -","4","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.1009","0.0506","","","0.0889","0.1005","","","","","","1.04","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555142","9.2819","0.0008","23.5334","0.0017","10.2751","0.0007","90","","111.152","0.003","90","","2093.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 N O3 S2 -","- C24 H21 N O3 S2 -","- C96 H84 N4 O12 S8 -","4","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.1492","0.0716","","","0.1659","0.1995","","","","","","1.017","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555143","8.2024","0.0004","10.5566","0.0005","11.0975","0.0005","68.8504","0.0013","79.7504","0.0014","71.2427","0.0014","846.51","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H15 N O5 S -","- C20 H15 N O5 S -","- C40 H30 N2 O10 S2 -","2","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.043","0.0349","","","0.0879","0.092","","","","","","1.051","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555144","11.095","0.003","12.561","0.004","24.147","0.007","90","","93.088","0.009","90","","3360.3","1.7","296","2","296","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C37 H30 N2 O3 S2 -","- C37 H30 N2 O3 S2 -","- C148 H120 N8 O12 S8 -","4","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.1246","0.0827","","","0.228","0.2418","","","","","","1.084","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555145","8.9049","0.0008","14.0612","0.0012","22.343","0.002","90","","93.263","0.003","90","","2793.1","0.4","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H26 N2 O4 S2 -","- C31 H26 N2 O4 S2 -","- C124 H104 N8 O16 S8 -","4","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.2165","0.093","","","0.2271","0.2662","","","","","","1.055","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555146","18.289","0.001","13.2118","0.0008","24.2095","0.0013","90","","91.165","0.0019","90","","5848.5","0.6","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H22 Cl2 N2 O3 S2 -","- C35 H22 Cl2 N2 O3 S2 -","- C280 H176 Cl16 N16 O24 S16 -","8","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.1565","0.0735","","","0.1527","0.1821","","","","","","1.025","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555147","7.6623","0.0005","10.2269","0.0007","19.008","0.0013","102.84","0.002","91.559","0.002","103.009","0.002","1410.29","0.17","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H28 N2 O4 S2 -","- C32 H28 N2 O4 S2 -","- C64 H56 N4 O8 S4 -","2","1","","Sun, Jing; Sun, Quan-Shun; Yan, Chao-Guo","Efficient synthesis of novel cyclic fused-phenothiazines via domino cyclization of 2-(benzo[b][1,4]thiazin-3-ylidene)acetate, aromatic aldehydes and cyclic 1,3-diketones","Organic Chemistry Frontiers","2019","6","20","3555","","10.1039/C9QO00951E","","","0.71073","MoKα","","0.092","0.0706","","","0.178","0.1879","","","","","","1.042","","","","has coordinates","238346","2020-10-21","18:00:00",""
"1555150","20.6626","0.0008","10.3356","0.0004","13.6724","0.0005","90","","123.325","0.002","90","","2439.76","0.17","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C25 H34.5 F3 N O1.25 -","- C25 H34 F3 N O4.25 -","- C100 H136 F12 N4 O17 -","4","1","","Sampaio-Dias, Ivo E.; Silva-Reis, Sara C.; Pinto da Silva, Luís; García-Mera, Xerardo; Maestro, Miguel A.; Rodríguez-Borges, José E.","Mechanistic insights for the transprotection of tertiary amines with Boc2O via charged carbamates: access to both enantiomers of 2-azanorbornane-3-exo-carboxylic acids","Organic Chemistry Frontiers","2019","6","20","3540","","10.1039/C9QO00957D","","","0.71073","MoKα","","0.0434","0.041","","","0.1123","0.1181","","","","","","1.083","","","","has coordinates","279649","2022-11-30","18:17:27",""
"1555152","33.942","0.004","11.5163","0.0011","9.4629","0.0009","90","","99.03","0.004","90","","3653.1","0.7","270","","270","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H21 N O3 S -","- C20 H21 N O3 S -","- C160 H168 N8 O24 S8 -","8","1","","Cecchini, Chiara; Cera, Gianpiero; Lanzi, Matteo; Marchiò, Luciano; Malacria, Max; Maestri, Giovanni","Diastereoselective bicyclization of enynols via gold catalysis","Organic Chemistry Frontiers","2019","6","20","3584","","10.1039/C9QO00963A","","","0.71073","MoKα","","0.1147","0.0516","","","0.1011","0.1309","","","","","","1.031","","","","has coordinates","238351","2020-10-21","18:00:00",""
"1555153","7.3872","0.0002","10.8747","0.0003","16.4977","0.0004","90","","90","","90","","1325.32","0.06","200","","200","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H16 O2 -","- C17 H16 O2 -","- C68 H64 O8 -","4","1","","Cecchini, Chiara; Cera, Gianpiero; Lanzi, Matteo; Marchiò, Luciano; Malacria, Max; Maestri, Giovanni","Diastereoselective bicyclization of enynols via gold catalysis","Organic Chemistry Frontiers","2019","6","20","3584","","10.1039/C9QO00963A","","","1.54184","CuKα","","0.0307","0.0306","","","0.0833","0.0835","","","","","","1.059","","","","has coordinates","238351","2020-10-21","18:00:00",""
"1555156","11.8298","0.0002","17.6502","0.0003","13.5929","0.0002","90","","90.058","0.001","90","","2838.17","0.08","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H38 O7 -","- C30 H38 O7 -","- C120 H152 O28 -","4","1","","Feng, Ziwen; Yuan, Zhenbo; Zhao, Xiaobin; Huang, Yue; Yao, Hequan","A [4 + 1] annulation of ortho-electrophile-substituted para-quinone methides for the synthesis of indanes and isoindolines","Organic Chemistry Frontiers","2019","6","20","3535","","10.1039/C9QO00977A","","","1.54178","CuKα","","0.0809","0.0702","","","0.1876","0.2034","","","","","","1.068","","","","has coordinates","238354","2020-10-21","18:00:00",""
"1555157","11.2677","0.0001","10.9396","0.0001","24.121","0.0003","90","","93.117","0.001","90","","2968.86","0.05","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H38 N2 O6 -","- C31 H38 N2 O6 -","- C124 H152 N8 O24 -","4","1","","Feng, Ziwen; Yuan, Zhenbo; Zhao, Xiaobin; Huang, Yue; Yao, Hequan","A [4 + 1] annulation of ortho-electrophile-substituted para-quinone methides for the synthesis of indanes and isoindolines","Organic Chemistry Frontiers","2019","6","20","3535","","10.1039/C9QO00977A","","","1.54178","CuKα","","0.0543","0.0487","","","0.1368","0.143","","","","","","1.047","","","","has coordinates","238354","2020-10-21","18:00:00",""
"1555159","10.0737","0.0005","6.1334","0.00019","13.8766","0.0006","90","","107.776","0.005","90","","816.45","0.06","109.2","0.5","109.2","0.5","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H19 N O5 -","- C20 H19 N O5 -","- C40 H38 N2 O10 -","2","1","","Sun, Zhaocui; Zhu, Nailiang; Zhou, Man; Huo, Xiaowei; Wu, Haifeng; Tian, Yu; Yang, Junshan; Ma, Guoxu; Yang, Yan-Long; Xu, Xudong","Clavipines A‒C, antiproliferative meroterpenoids with a fused azepine skeleton from the basidiomycete Clitocybe clavipes","Organic Chemistry Frontiers","2019","6","22","3759","","10.1039/C9QO01005J","","x-ray","1.54184","CuKα","","0.0376","0.037","","","0.0938","0.0945","","","","","","1.047","","","","has coordinates","238356","2020-10-21","18:00:00",""
"1555160","8.594","0.0003","11.8962","0.0008","13.1105","0.0005","90","","90","","90","","1340.36","0.11","109.65","0.1","109.65","0.1","","","","","","","Clitocybe Clavipes","3","P 21 21 21","P 2ac 2ab","19","clavilactone A","","","- C16 H14 O5 -","- C16 H14 O5 -","- C64 H56 O20 -","4","1","","Sun, Zhaocui; Zhu, Nailiang; Zhou, Man; Huo, Xiaowei; Wu, Haifeng; Tian, Yu; Yang, Junshan; Ma, Guoxu; Yang, Yan-Long; Xu, Xudong","Clavipines A‒C, antiproliferative meroterpenoids with a fused azepine skeleton from the basidiomycete Clitocybe clavipes","Organic Chemistry Frontiers","2019","6","22","3759","","10.1039/C9QO01005J","","x-ray","1.54184","CuKα","","0.0389","0.0384","","","0.0986","0.0991","","","","","","1.09","","","","has coordinates","238356","2020-10-21","18:00:00",""
"1555164","11.6812","0.0011","6.6839","0.001","13.6312","0.001","90","","90","","90","","1064.3","0.2","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C11 H6 Cl2 O S -","- C11 H6 Cl2 O S -","- C44 H24 Cl8 O4 S4 -","4","0.5","","Wang, Ting; An, Zhenyu; Qi, Zhenjie; Zhuang, Daijiao; Chang, Aosheng; Yang, Yunxia; Yan, Rulong","Ring-opening/annulation reaction of cyclopropyl ethanols: concise access to thiophene aldehydes via C‒S bond formation","Organic Chemistry Frontiers","2019","6","21","3705","","10.1039/C9QO01014A","","","0.71073","MoKα","","0.0773","0.0459","","","0.1039","0.1271","","","","","","1.053","","","","has coordinates","238360","2020-10-21","18:00:00",""
"1555166","9.5954","0.0004","12.6894","0.0004","11.2412","0.0004","90","","112.927","0.004","90","","1260.6","0.09","100","0.3","100","0.3","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28 H24 Cl N3 O4 S -","- C28 H24 Cl N3 O4 S -","- C56 H48 Cl2 N6 O8 S2 -","2","1","","Zhang, Haoran; Li, Shiwu; Kang, Qiang; Du, Yu","Chiral-at-metal rhodium(iii) complex catalyzed enantioselective synthesis of C2-substituted benzofuran derivatives","Organic Chemistry Frontiers","2019","6","21","3683","","10.1039/C9QO01022J","","","1.54184","CuKα","","0.0477","0.0402","","","0.089","0.0936","","","","","","1.031","","","","has coordinates","238362","2020-10-21","18:00:00",""
"1555168","10.8289","0.0002","10.4035","0.0002","17.1866","0.0003","90","","103.19","0.002","90","","1885.14","0.06","120","2","120","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C19 H18 N2 O6 Si -","- C19 H18 N2 O6 Si -","- C76 H72 N8 O24 Si4 -","4","1","","Vale, João R.; Valkonen, Arto; Afonso, Carlos A. M.; Candeias, Nuno R.","Synthesis of silacyclopent-2-en-4-ols via intramolecular [2 + 2] photocycloaddition of benzoyl(allyl)silanes","Organic Chemistry Frontiers","2019","6","22","3793","","10.1039/C9QO01028A","","","1.54184","CuKα","","0.0279","0.0274","","","0.0735","0.0741","","","","","","1.025","","","","has coordinates","238364","2020-10-21","18:00:00",""
"1555169","5.9864","0.0001","18.2027","0.0004","21.5323","0.0004","90","","90","","90","","2346.35","0.08","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H22 N2 O6 Si -","- C25 H22 N2 O6 Si -","- C100 H88 N8 O24 Si4 -","4","1","","Vale, João R.; Valkonen, Arto; Afonso, Carlos A. M.; Candeias, Nuno R.","Synthesis of silacyclopent-2-en-4-ols via intramolecular [2 + 2] photocycloaddition of benzoyl(allyl)silanes","Organic Chemistry Frontiers","2019","6","22","3793","","10.1039/C9QO01028A","","","1.54184","CuKα","","0.0383","0.0344","","","0.0848","0.0875","","","","","","1.022","","","","has coordinates","238364","2020-10-21","18:00:00",""
"1555173","25.9119","0.0007","7.4654","0.0002","11.5725","0.0003","90","","107.999","0.001","90","","2129.06","0.1","100","2","100","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C24 H32 O5 -","- C24 H32 O5 -","- C96 H128 O20 -","4","1","","Wang, Jia-Peng; Shu, Yan; Liu, Shi-Xi; Hu, Jun-Tao; Sun, Cheng-Tong; Zhou, Hao; Gan, Dong; Cai, Xue-Yun; Pu, Wei; Cai, Le; Ding, Zhong-Tao","Expanstines A‒D: four unusual isoprenoid epoxycyclohexenones generated by Penicillium expansum YJ-15 fermentation and photopromotion","Organic Chemistry Frontiers","2019","6","23","3839","","10.1039/C9QO01076A","","","1.54178","CuKα","","0.053","0.0525","","","0.1389","0.1396","","","","","","1.06","","","","has coordinates","238367","2020-10-21","18:00:00",""
"1555174","12.7263","0.0005","18.5197","0.0007","24.0727","0.0009","90","","90","","90","","5673.6","0.4","100","2","100","2","","","","","","","Penicillium expansum YJ-15","3","P 21 21 21","P 2ac 2ab","19","","expanstine D","","- C22 H30.66667 O4.33333 -","- C22 H30.6667 O4.33333 -","- C264 H368 O52 -","12","3","","Wang, Jia-Peng; Shu, Yan; Liu, Shi-Xi; Hu, Jun-Tao; Sun, Cheng-Tong; Zhou, Hao; Gan, Dong; Cai, Xue-Yun; Pu, Wei; Cai, Le; Ding, Zhong-Tao","Expanstines A–D: four unusual isoprenoid epoxycyclohexenones generated by Penicillium expansum YJ-15 fermentation and photopromotion","Organic Chemistry Frontiers","2019","6","23","3839","","10.1039/C9QO01076A","","","1.54178","CuKα","","0.0494","0.0427","","","0.1223","0.1322","","","","","","0.987","","","","has coordinates","275856","2022-06-07","07:08:27",""
"1555176","20.3875","0.0007","20.3875","0.0007","7.4174","0.0003","90","","90","","120","","2669.99","0.17","100","2","100","2","","","","","","","Fungal Co-culture of Epicoccum sp. and Armillaria sp.","3","P 65","P 65","170","","Epicorpenoid A","","- C18 H26 O6 -","- C18 H26 O6 -","- C108 H156 O36 -","6","1","","Li, Hong-Tao; Tang, Linhuan; Liu, Tao; Yang, Ruining; Yang, Yabin; Zhou, Hao; Ding, Zhong-Tao","Polyoxygenated meroterpenoids and a bioactive illudalane derivative from a co-culture of Armillaria sp. and Epicoccum sp.","Organic Chemistry Frontiers","2019","6","23","3847","","10.1039/C9QO01087D","","","1.54178","CuKα","","0.0256","0.0254","","","0.0844","0.0852","","","","","","0.831","","","","has coordinates","238369","2020-10-21","18:00:00",""
"1555178","10.4723","0.0007","12.7127","0.0009","12.7391","0.0009","113.157","0.007","97.019","0.006","110.996","0.006","1385.7","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H27.62 N2 O6 -","- C34 H26.08 N2 O6 -","- C68 H52.16 N4 O12 -","2","1","","Chen, Meng-Ting; Zhang, Yang; Vysotsky, Myroslav O.; Lindner, Joachim O.; Li, Meng-Hua; Lin, Mei-Jin; Würthner, Frank","1,1′-Bi(2-naphthol-4,5-dicarboximide)s: blue emissive axially chiral scaffolds with aggregation-enhanced emission properties","Organic Chemistry Frontiers","2019","6","22","3731","","10.1039/C9QO01090D","","x-ray","0.71073","MoKα","","0.1197","0.0784","","","0.2369","0.2764","","","","","","1.071","","","","has coordinates,has disorder","238371","2020-10-21","18:00:00",""
"1555179","12.287","0.0013","13.2979","0.0016","27.85","0.004","86.66","0.013","90","","90","","4542.7","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C51 H52 N2 O7 -","- C51 H52 N2 O7 -","- C204 H208 N8 O28 -","4","2","","Chen, Meng-Ting; Zhang, Yang; Vysotsky, Myroslav O.; Lindner, Joachim O.; Li, Meng-Hua; Lin, Mei-Jin; Würthner, Frank","1,1′-Bi(2-naphthol-4,5-dicarboximide)s: blue emissive axially chiral scaffolds with aggregation-enhanced emission properties","Organic Chemistry Frontiers","2019","6","22","3731","","10.1039/C9QO01090D","","","0.71073","MoKα","","0.2354","0.107","","","0.2667","0.349","","","","","","1.008","","","","has coordinates,has disorder","279649","2022-11-30","18:17:27",""
"1555180","32.9549","0.0008","12.7486","0.0002","24.5123","0.0006","90","","90","","90","","10298.3","0.4","100","0.1","100","0.1","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C32 H28 N2 O6 -","- C31.4775 H25.2 N2 O6 -","- C503.64 H403.2 N32 O96 -","16","4","","Chen, Meng-Ting; Zhang, Yang; Vysotsky, Myroslav O.; Lindner, Joachim O.; Li, Meng-Hua; Lin, Mei-Jin; Würthner, Frank","1,1′-Bi(2-naphthol-4,5-dicarboximide)s: blue emissive axially chiral scaffolds with aggregation-enhanced emission properties","Organic Chemistry Frontiers","2019","6","22","3731","","10.1039/C9QO01090D","","x-ray","1.54184","CuKα","","0.1779","0.1534","","","0.3425","0.3669","","","","","","1.351","","","","has coordinates,has disorder","279649","2022-11-30","18:17:27",""
"1555182","11.6007","0.0008","5.7368","0.0005","15.0074","0.001","90","","101.62","0.007","90","","978.29","0.13","293.8","0.4","293.8","0.4","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H18 O5 -","- C25 H18 O5 -","- C50 H36 O10 -","2","1","","Zhang, Song; Yu, Xiaojun; Pan, Jianke; Jiang, Chunhui; Zhang, Hongsu; Wang, Tianli","Asymmetric synthesis of spiro-structural 2,3-dihydrobenzofurans via the bifunctional phosphonium salt-promoted [4 + 1] cyclization of ortho-quinone methides with α-bromoketones","Organic Chemistry Frontiers","2019","6","22","3799","","10.1039/C9QO01096C","","x-ray","1.54184","CuKα","","0.0635","0.0579","","","0.1605","0.1702","","","","","","1.039","","","","has coordinates","238373","2020-10-21","18:00:00",""
"1555184","11.4043","0.0011","9.8807","0.001","25.367","0.003","90","","93.04","0.003","90","","2854.4","0.5","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H19 N O3 -","- C16 H19 N O3 -","- C128 H152 N8 O24 -","8","2","","Zhong, Jiaxin; He, Haibing; Gao, Shuanhu","Exploration of 1,3-dipolar cycloaddition reactions to construct the core skeleton of Calyciphylline A-type alkaloids","Organic Chemistry Frontiers","2019","6","22","3781","","10.1039/C9QO01111K","","","0.71073","MoKα","","0.1091","0.0465","","","0.0967","0.1238","","","","","","1.001","","","","has coordinates","238375","2020-10-21","18:00:00",""
"1555185","24.4812","0.0004","7.9863","0.0001","25.3899","0.0003","90","","103.221","0.001","90","","4832.51","0.12","100","0.1","100","0.1","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C26 H37 N O8 -","- C26 H37 N O8 -","- C208 H296 N8 O64 -","8","2","","Zhong, Jiaxin; He, Haibing; Gao, Shuanhu","Exploration of 1,3-dipolar cycloaddition reactions to construct the core skeleton of Calyciphylline A-type alkaloids","Organic Chemistry Frontiers","2019","6","22","3781","","10.1039/C9QO01111K","","x-ray","1.54184","CuKα","","0.0582","0.0577","","","0.1522","0.1526","","","","","","1.068","","","","has coordinates","275434","2022-05-16","05:31:57",""
"1555186","8.3885","0.0001","24.6653","0.0002","19.7148","0.0001","90","","97.294","0.001","90","","4046.08","0.06","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H29 N O5 -","- C22 H29 N O5 -","- C176 H232 N8 O40 -","8","2","","Zhong, Jiaxin; He, Haibing; Gao, Shuanhu","Exploration of 1,3-dipolar cycloaddition reactions to construct the core skeleton of Calyciphylline A-type alkaloids","Organic Chemistry Frontiers","2019","6","22","3781","","10.1039/C9QO01111K","","x-ray","1.54184","CuKα","","0.0458","0.0435","","","0.1068","0.1084","","","","","","1.04","","","","has coordinates","275434","2022-05-16","05:31:57",""
"1555189","11.1372","0.0011","8.2426","0.0008","12.2345","0.0012","90","","110.187","0.001","90","","1054.13","0.18","296.15","","296.15","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H23 N O3 S -","- C25 H23 N O3 S -","- C50 H46 N2 O6 S2 -","2","1","","Chen, Ying-Han; Lv, Xue-Jiao; You, Zhi-Hao; Liu, Yan-Kai","Asymmetric organocatalyzed reaction sequence of 2-hydroxy cinnamaldehydes and acyclic N-sulfonyl ketimines to construct diverse chiral bridged polycyclic aminals","Organic Chemistry Frontiers","2019","6","22","3725","","10.1039/C9QO01116A","","","0.71073","MoKα","","0.0434","0.0336","","","0.0807","0.086","","","","","","1.048","","","","has coordinates","238378","2020-10-21","18:00:00",""
"1555190","26.476","0.004","9.6581","0.0015","9.1391","0.0014","90","","98.974","0.003","90","","2308.3","0.6","296.15","","296.15","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C25 H25 N O4 S -","- C25 H25 N O4 S -","- C100 H100 N4 O16 S4 -","4","1","","Chen, Ying-Han; Lv, Xue-Jiao; You, Zhi-Hao; Liu, Yan-Kai","Asymmetric organocatalyzed reaction sequence of 2-hydroxy cinnamaldehydes and acyclic N-sulfonyl ketimines to construct diverse chiral bridged polycyclic aminals","Organic Chemistry Frontiers","2019","6","22","3725","","10.1039/C9QO01116A","","","0.71073","MoKα","","0.0634","0.0416","","","0.0848","0.095","","","","","","1.017","","","","has coordinates","238378","2020-10-21","18:00:00",""
"1555191","8.784","0.003","9.976","0.003","12.349","0.004","90","","90.656","0.005","90","","1082.1","0.6","296.15","","296.15","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H23 N O3 S -","- C25 H23 N O3 S -","- C50 H46 N2 O6 S2 -","2","1","","Chen, Ying-Han; Lv, Xue-Jiao; You, Zhi-Hao; Liu, Yan-Kai","Asymmetric organocatalyzed reaction sequence of 2-hydroxy cinnamaldehydes and acyclic N-sulfonyl ketimines to construct diverse chiral bridged polycyclic aminals","Organic Chemistry Frontiers","2019","6","22","3725","","10.1039/C9QO01116A","","","0.71073","MoKα","","0.0609","0.0472","","","0.1244","0.1376","","","","","","1.033","","","","has coordinates","238378","2020-10-21","18:00:00",""
"1555193","13.65","0.003","9.7451","0.0019","19.194","0.004","90","","105.2","0.03","90","","2463.9","1","293","2","293","2","","","","","","","Synthetic","5","P 1 21/c 1","-P 2ybc","14","","7-(2H-Indazol-2-yl)-11-tosyl-6a,11a-dihydro-11H-benzo[a]carbazole","","- C30 H23 N3 O2 S -","- C30 H23 N3 O2 S -","- C120 H92 N12 O8 S4 -","4","1","","Vivek Kumar, Sundaravel; Banerjee, Sonbidya; Punniyamurthy, Tharmalingam","Rh-Catalyzed C‒C/C‒N bond formation via C‒H activation: synthesis of 2H-indazol-2-yl-benzo[a]carbazoles","Organic Chemistry Frontiers","2019","6","23","3885","","10.1039/C9QO01120J","","","0.71073","MoKα","","0.0793","0.053","","","0.1282","0.1483","","","","","","1.023","","","","has coordinates,has disorder","238380","2020-10-21","18:00:00",""
"1555195","9.8054","0.0005","11.1916","0.0005","13.8588","0.0006","102.001","0.002","100.882","0.001","107.337","0.001","1367.85","0.11","296","2","296.15","","","","","","","","","5","P -1","-P 1","2","","","","- C31 H29 N3 O3 S -","- C31 H29 N3 O3 S -","- C62 H58 N6 O6 S2 -","2","1","","Wang, Fei; Xu, Pei; Liu, Bei-Bei; Wang, Shun-Yi; Ji, Shun-Jun","Pd-Catalyzed multicomponent reaction of sulfonyl azides, primary amines and methyl α-isocyanoacetates: highly efficient synthesis of tetrasubstituted imidazolone derivatives","Organic Chemistry Frontiers","2019","6","22","3754","","10.1039/C9QO01122F","","","0.71073","MoKα","","0.1029","0.0647","","","0.1392","0.1555","","","","","","1.039","","","","has coordinates","238382","2020-10-21","18:00:00",""
"1555198","8.4028","0.0002","8.4685","0.0002","18.8231","0.0005","90","","91.121","0.002","90","","1339.18","0.06","100","2","100.01","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C68 H56 N8 O8 -","4","1","","Wössner, Jan S.; Grenz, David C.; Kratzert, Daniel; Esser, Birgit","Tuning the optical properties of spiro-centered charge-transfer dyes by extending the donor or acceptor part","Organic Chemistry Frontiers","2019","6","21","3649","","10.1039/C9QO01134J","","","0.71073","MoKα","","0.0432","0.0365","","","0.0881","0.0926","","","","","","1.03","","","","has coordinates","238386","2020-10-21","18:00:00",""
"1555199","28.7181","0.0008","16.094","0.0004","7.4702","0.0002","90","","90","","90","","3452.65","0.16","100","2","99.98","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C23 H18 N2 O2 -","- C23 H18 N2 O2 -","- C184 H144 N16 O16 -","8","2","","Wössner, Jan S.; Grenz, David C.; Kratzert, Daniel; Esser, Birgit","Tuning the optical properties of spiro-centered charge-transfer dyes by extending the donor or acceptor part","Organic Chemistry Frontiers","2019","6","21","3649","","10.1039/C9QO01134J","","","0.71073","MoKα","","0.0623","0.047","","","0.0946","0.1004","","","","","","1.037","","","","has coordinates","238386","2020-10-21","18:00:00",""
"1555200","8.899","0.008","16.027","0.013","21.774","0.019","90","","90","","90","","3106","5","100","2","100.01","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C21 H16 N2 O2 -","- C21 H16 N2 O2 -","- C168 H128 N16 O16 -","8","1","","Wössner, Jan S.; Grenz, David C.; Kratzert, Daniel; Esser, Birgit","Tuning the optical properties of spiro-centered charge-transfer dyes by extending the donor or acceptor part","Organic Chemistry Frontiers","2019","6","21","3649","","10.1039/C9QO01134J","","x-ray","0.71073","MoKα","","0.1027","0.0676","","","0.1251","0.1376","","","","","","1.104","","","","has coordinates","238386","2020-10-21","18:00:00",""
"1555201","14.7127","0.0013","13.2097","0.0016","27.114","0.003","90","","97.327","0.009","90","","5226.6","1","100","","100.01","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C35 H24 N4 O3 -","- C35 H24 N4 O3 -","- C280 H192 N32 O24 -","8","2","","Wössner, Jan S.; Grenz, David C.; Kratzert, Daniel; Esser, Birgit","Tuning the optical properties of spiro-centered charge-transfer dyes by extending the donor or acceptor part","Organic Chemistry Frontiers","2019","6","21","3649","","10.1039/C9QO01134J","","x-ray","0.71073","MoKα","","0.092","0.0563","","","0.1316","0.1489","","","","","","1.061","","","","has coordinates","273808","2022-03-18","10:32:16",""
"1555202","16.535","0.0007","8.4288","0.0004","22.1228","0.0009","90","","90","","90","","3083.3","0.2","100","","100.16","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C21 H16 N2 O2 -","- C21 H16 N2 O2 -","- C168 H128 N16 O16 -","8","1","","Wössner, Jan S.; Grenz, David C.; Kratzert, Daniel; Esser, Birgit","Tuning the optical properties of spiro-centered charge-transfer dyes by extending the donor or acceptor part","Organic Chemistry Frontiers","2019","6","21","3649","","10.1039/C9QO01134J","","x-ray","0.71073","MoKα","","0.0729","0.0557","","","0.1381","0.1519","","","","","","1.061","","","","has coordinates","238386","2020-10-21","18:00:00",""
"1555203","8.36","0.005","9.772","0.004","13.225","0.006","79.646","0.011","71.931","0.019","81.249","0.016","1005","0.9","100","2","99.96","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H19 N3 O2 -","- C28 H19 N3 O2 -","- C56 H38 N6 O4 -","2","1","","Wössner, Jan S.; Grenz, David C.; Kratzert, Daniel; Esser, Birgit","Tuning the optical properties of spiro-centered charge-transfer dyes by extending the donor or acceptor part","Organic Chemistry Frontiers","2019","6","21","3649","","10.1039/C9QO01134J","","x-ray","0.71073","MoKα","","0.0594","0.0511","","","0.1406","0.1468","","","","","","1.071","","","","has coordinates","238386","2020-10-21","18:00:00",""
"1555204","14.667","0.004","9.231","0.003","15.139","0.004","90","","107.187","0.008","90","","1958.2","1","100","","100.03","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H16 Br2 N2 O2 -","- C23 H16 Br2 N2 O2 -","- C92 H64 Br8 N8 O8 -","4","1","","Wössner, Jan S.; Grenz, David C.; Kratzert, Daniel; Esser, Birgit","Tuning the optical properties of spiro-centered charge-transfer dyes by extending the donor or acceptor part","Organic Chemistry Frontiers","2019","6","21","3649","","10.1039/C9QO01134J","","x-ray","0.71073","MoKα","","0.0254","0.0212","","","0.0497","0.051","","","","","","1.052","","","","has coordinates","238386","2020-10-21","18:00:00",""
"1555205","18.714","0.003","15.974","0.003","12.0964","0.0018","90","","90","","90","","3616.1","1","100","2","99.99","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C25 H18 N2 O2 -","- C25 H18 N2 O2 -","- C200 H144 N16 O16 -","8","1","","Wössner, Jan S.; Grenz, David C.; Kratzert, Daniel; Esser, Birgit","Tuning the optical properties of spiro-centered charge-transfer dyes by extending the donor or acceptor part","Organic Chemistry Frontiers","2019","6","21","3649","","10.1039/C9QO01134J","","x-ray","0.71073","MoKα","","0.0605","0.0423","","","0.0983","0.109","","","","","","1.028","","","","has coordinates","238386","2020-10-21","18:00:00",""
"1555209","28.8585","0.0006","28.8585","0.0006","37.617","0.0004","90","","90","","120","","27130.8","0.8","100","2","100","","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","","","- C44.4 H38.4 N1.2 S1.8 -","- C44.4 H38.4 N1.2 S1.8 -","- C888 H768 N24 S36 -","20","1.66667","","Ghosh, Arindam; Dash, Syamasrit; Srinivasan, A.; Suresh, C. H.; Peruncheralathan, S.; Chandrashekar, Tavarekere K.","Core-modified 48π and 42π decaphyrins: syntheses, properties and structures","Organic Chemistry Frontiers","2019","6","22","3746","","10.1039/C9QO01162E","","","1.54184","CuKα","","0.0697","0.0421","","","0.0947","0.1041","","","","","","0.828","","","","has coordinates","238390","2020-10-21","18:00:00",""
"1555210","8.69725","0.00017","10.9283","0.0002","20.5323","0.0005","84.0758","0.0017","88.6243","0.0018","67.6514","0.0018","1795.05","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H22.67 N2.67 S2 -","- C28 H22.6667 N2.66667 S2 -","- C84 H68 N8 S6 -","3","1.5","","Ghosh, Arindam; Dash, Syamasrit; Srinivasan, A.; Suresh, C. H.; Peruncheralathan, S.; Chandrashekar, Tavarekere K.","Core-modified 48π and 42π decaphyrins: syntheses, properties and structures","Organic Chemistry Frontiers","2019","6","22","3746","","10.1039/C9QO01162E","","x-ray","1.54184","CuKα","","0.0852","0.0779","","","0.2323","0.2367","","","","","","1.092","","","","has coordinates","238390","2020-10-21","18:00:00",""
"1555212","10.0558","0.0007","10.1395","0.0005","18.5575","0.001","90","","98.819","0.006","90","","1869.77","0.19","292.9","0.1","292.9","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 O3 -","- C24 H24 O3 -","- C96 H96 O12 -","4","1","","Jiao, Meng-Jie; Liu, Dan; Hu, Xiu-Qin; Xu, Peng-Fei","Photocatalytic decarboxylative [2 + 2 + 1] annulation of 1,6-enynes with N-hydroxyphthalimide esters for the synthesis of indene-containing polycyclic compounds","Organic Chemistry Frontiers","2019","6","23","3834","","10.1039/C9QO01166H","","x-ray","0.71073","MoKα","","0.1486","0.1088","","","0.2683","0.3231","","","","","","1.052","","","","has coordinates","238392","2020-10-21","18:00:00",""
"1555215","9.2204","0.0018","24.665","0.005","11.584","0.002","90","","105.11","0.03","90","","2543.4","0.9","113","2","113.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 Br F3 N4 O4 -","- C26 H22 Br F3 N4 O4 -","- C104 H88 Br4 F12 N16 O16 -","4","1","","Zhao, Hong-Wu; Guo, Jia-Ming; Wang, Li-Ru; Ding, Wan-Qiu; Tang, Zhe; Song, Xiu-Qing; Wu, Hui-Hui; Fan, Xiao-Zu; Bi, Xiao-Fan","Diastereoselective formal [3 + 3] cycloaddition of isatin-based α-(trifluoromethyl)imines with N,N′-dialkyloxyureas","Organic Chemistry Frontiers","2019","6","23","3891","","10.1039/C9QO01181A","","","0.71073","MoKα","","0.0779","0.0556","","","0.1249","0.137","","","","","","1.047","","","","has coordinates","238395","2020-10-21","18:00:00",""
"1555217","12.15","0.002","12.226","0.0015","26.113","0.004","99.044","0.006","97.039","0.018","99.079","0.011","3739.3","1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C63.25 H86 Na5 O29.95 S5 -","- C63.25 H86 Na5 O29.95 S5 -","- C126.5 H172 Na10 O59.9 S10 -","2","1","","Pisagatti, Ilenia; Barbera, Lucia; Gattuso, Giuseppe; Parisi, Melchiorre F.; Geremia, Silvano; Hickey, Neal; Notti, Anna","Guest-length driven high fidelity self-sorting in supramolecular capsule formation of calix[5]arenes in water","Organic Chemistry Frontiers","2019","6","22","3804","","10.1039/C9QO01188A","","x-ray","0.7","Synchrotron","","0.1558","0.1449","","","0.37","0.3778","","","","","","1.036","","","","has coordinates,has disorder","238397","2020-10-21","18:00:00",""