The keto–enol equilibrium and thermal conversion kinetics of 2- and 4-hydroxyacetophenone in the gas phase: a DFT study
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DOI: 10.1080/00268976.2017.1374483
Abstract: ABSTRACT Keto–enol tautomeric equilibrium and the mechanism of thermal conversion of 2- and 4-hydroxyacetophenone in gas phase have been studied by means of electronic structure calculations using density functional theory (DFT). A topological analysis of… read more here.
Keywords: mechanism; keto enol; hydroxyacetophenone gas; thermal conversion ... See more keywords