DFT Study on the Possible Intramolecular Rearrangement of Four Monocyclic Monoterpenes
As the basis and preliminary work of future experimental study on PAHs formation under high temperature, theoretical computations on the intramolecular rearrangement reactions of sylvestrene (1-methyl-3-vinylcyclohexene) and 1,4-dimethyl-4-vinylcyclohexene are conducted and reveal that they may be t...
Main Authors: | , , |
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Format: | Article |
Language: | English |
Published: |
Iranian Institute of Research and Development in Chemical Industries (IRDCI)-ACECR
2018-02-01
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Series: | Iranian Journal of Chemistry & Chemical Engineering |
Subjects: | |
Online Access: | http://www.ijcce.ac.ir/article_31973_4c7a470a5bb22b5da2083ba284324ad2.pdf |