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Using Bases as Initiators to Isomerize Allylic Alcohols: Insights from Density Functional Theory Studies

Zhang, L; Wang, B; Zhao, YQ; Pu, M; Liu, SB; Lei, M

Lei, M (corresponding author), Beijing Univ Chem Technol, Coll Chem, Inst Computat Chem, State Key Lab Chem Resource Engn, Beijing 100029, Peoples R China.; Liu, SB (corresponding author), Univ N Carolina, Res Comp Ctr, Chapel Hill, NC 27599 USA.

JOURNAL OF PHYSICAL CHEMISTRY A, 2021; 125 (11): 2316

Abstract

Allylic alcohols, as common and readily available building blocks, could be converted into many widely used carbonyl compounds through isomerization r......

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