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Rate constants for reactions of ethylbenzene with hydroperoxyl radical

✍ Scribed by Mohammednoor Khalil Altarawneh; Bogdan Z. Dlugogorski; Eric M. Kennedy; John C. Mackie

Book ID
119220189
Publisher
Elsevier Science
Year
2013
Tongue
English
Weight
688 KB
Volume
160
Category
Article
ISSN
0010-2180

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Rate constants for hydrogen abstraction reactions by the hydroperoxyl radical from methanol, ethenol, acetaldehyde, toluene, and phenol
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An important step in the initial oxidation of hydrocarbons at low to intermediate temperatures is the abstraction of H by hydroperoxyl radical (HO(2)). In this study, we calculate energy profiles for the sequence: reactant + HO(2) β†’ [complex of reactants] β†’ transition state β†’ [complex of products] β†’