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Theoretical design of new very potent free radical scavengers

โœ Scribed by Lespade, Laure


Book ID
121438083
Publisher
Elsevier
Year
2013
Tongue
English
Weight
419 KB
Volume
1009
Category
Article
ISSN
2210-271X

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โœ Zhang, Hong-Yu ๐Ÿ“‚ Article ๐Ÿ“… 2000 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 950 KB

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 Oร€H bond dissociation energy (BDE) of antioxidant. Through a comparison between DHOF of model mole