Enantioselective organocatalytic diels-Alder reactions: A density functional theory and kinetic isotope effects study

The mechanism and enantioselectivity of the organocatalytic Diels-Alder reaction were computationally investigated by density functional theory at the B3LYP/6-31G(d) level of theory. The uncatalyzed Diels-Alder reaction was also studied to explore the effect of the organocatalyst on this reaction in...

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Bibliographic Details
Main Authors: Omar, N.Y.M., Rahman, N.A., Zain, S.M.D.
Published: 2018
Online Access:http://dspace.uniten.edu.my/jspui/handle/123456789/9789