The difference of heat of formation between parent molecule and its free radical (DHOF), calculated by semiempirical quantum chemical method AM1, was employed as a theoretical index to characterize the OΓH bond dissociation energy (BDE) of antioxidant. Through a comparison between DHOF of model mole
A theoretical investigation of the properties of free radicals
β Scribed by G. Leroy
- Publisher
- Elsevier Science
- Year
- 1983
- Tongue
- English
- Weight
- 685 KB
- Volume
- 93
- Category
- Article
- ISSN
- 0022-2860
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