Dissociation of the tertiary butanol rad
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William Beveridge; Iain W. Garioch; John A. Hunter; Chris A. F. Johnson; John E.
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Article
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1991
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John Wiley and Sons
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English
⚖ 442 KB
The ionization and lowest energy unimolecular dissociation of tert-butanol were modelled by ab initio molecular orbital methods. The ion is formed on a repulsive surface and gives a methyl radical and protonated acetone as products with the liberation of 0.54 eV of energy. The calculations predict t