Theoretical insights into the enantioselectivity and mechanism of Diels-Alder reactions involving chiral cationic oxazaborolidinium catalyst

The chiral oxazaborolidinium ion catalyzed Diels-Alder reaction between 2-methyl-1,3-butadiene and 2,3-dimethyl-1,4-benzoquinone was studied by means of density functional theory (DFT) at the B3LYP/6-31G(d) level of theory. Different DFT-based theoretical approaches including the reaction force, the...

Full description

Saved in:
Bibliographic Details
Main Authors: Omar, N.Y.M., Rahman, N.A., Zain, S.Md.
Format:
Published: 2018
Online Access:http://dspace.uniten.edu.my/jspui/handle/123456789/9793
Tags: Add Tag
No Tags, Be the first to tag this record!