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- W793560891 abstract "The addition of thiophenol to -methylstyrene has been studied MO theoretically using CNDO/2 method. Although overall reaction proceeds in two steps i.e., (1) decomposition of thiophenol to give phenylthiyl radical and (2) addition of the radical to -methylstyrene to give a new monomer radical, theoretical results suggested that the phenylthiyl radical formation step, (1), was the dominant process in determining the rate of addition; this was the rationale behind the negative value obtained experimentally from the Hammett plots for substituents on the thiyl radicals. The departure from a linear Hammett plot for addition of -chlorophenylthiyl and m-trifluoromethyl phenylthiyl to -methoxy--methylstyrene could be explained as a result of an increased contribution of the addition step, (2) to the overall reaction rate." @default.
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- W793560891 date "1982-01-01" @default.
- W793560891 modified "2023-09-23" @default.
- W793560891 title "Determination of Reactivity by MO Theory (XXII). MO Studies of Substituent Effects of Rates of Phenylthiyl Radical Additions to ${alpha}$-Methylstyrene" @default.
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