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The quantum chemical study of the mechanism of the epoxidation reaction of limonene and geraniol with peracetic and perbenzoic acids

Aim. To compare the mechanism of the epoxidation reaction of terpenes Geraniol and Limonene with peracetic acid and perbenzoic acid based on the quantum chemical study. Materials and methods. For the calculation the density functional theory (approximation UBH & HLYP/6-31G (d) Gaussian 09) meth...

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Main Authors: O. M. Agafonov, S. I. Okovytyy, M. Ye. Blazheyevskiy
格式: Artigo
語言:Inglês
出版: National University of Pharmacy (Kharkiv, Ukraine) 2019-02-01
叢編:Журнал органічної та фармацевтичної хімії
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在線閱讀:http://ophcj.nuph.edu.ua/article/view/ophcj.19.963/159132
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