Mechanisms and Origins of Periselectivity of the Ambimodal [6 + 4] Cycloadditions of Tropone to Dimethylfulvene

Journal of the American Chemical Society

Volumn 139, Issue 24, 2017, Pages 8251-8258

  Yu, Peiyuan ^a   Chen, Tiffany Q ^a   Yang, Zhongyue ^a   He, Cyndi Qixin ^a   Patel, Ashay ^a   Lam, Yu Hong ^a   Liu, Ching Yang ^b   Houk, K N ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b CHINESE CULTURE UNIVERSITY   (Taiwan)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; MOLECULAR DYNAMICS; REACTION KINETICS;

COPE REARRANGEMENT; CYCLOPENTADIENES; DIRECT MOLECULAR DYNAMICS; MOLECULAR DYNAMICS SIMULATIONS; REACTION MECHANISM; SIGMATROPIC SHIFTS; STEREO-SELECTIVE; TRANSITION STATE;

CYCLOADDITION;

ALKENE; DIMETHYLFULVENE; HYDROGEN; METHYL GROUP; TROPONE DERIVATIVE; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; ARTICLE; COPE REARRANGEMENT; CYCLOADDITION; DENSITY FUNCTIONAL THEORY; ENANTIOSELECTIVITY; MOLECULAR DYNAMICS; STEREOSELECTIVITY;

EID: 85021062677     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/jacs.7b02966     Document Type: Article

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