Photoisomerization of Methyl Vinyl Ketone and Methacrolein in the Troposphere: A Theoretical Investigation of Ground-State Reaction Pathways

The ground-state rearrangement and decomposition of methyl vinyl ketone (MVK) and methacrolein (MACR) has been investigated using quantum chemical calculations and RRKM theory/master equation simulations. MVK and MACR absorb actinic radiation at around 380–280 nm, and we have identified a number of...

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Veröffentlicht in:ACS earth and space chemistry 2018-08, Vol.2 (8), p.753-763
Hauptverfasser: So, Sui, Wille, Uta, da Silva, Gabriel
Format: Artikel
Sprache:eng
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