Hydrogen atom transfer in the reaction of hydroxycinnamic acids with {radical dot}OH and {radical dot}HO2 radicals: DFT study

Journal of Molecular Structure: THEOCHEM

Volumn 862, Issue 1-3, 2008, Pages 53-59

  Nsangou, M ^a   Fifen, J J ^a   Dhaouadi, Z ^b   Lahmar, S ^b  

^a UNIVERSITY OF NGAOUNDERE   (Cameroon)

^b FACULTÉ DES SCIENCES DE TUNIS   (Tunisia)

Author keywords

3,4 Dihydroxycinnamic acid; 4 Hydroxycinnamic acid; 6 31+G**; Antioxidants; B3LYP; DFT; Hydrogen atom transfer; NBO; Radicals

Indexed keywords

EID: 46749100104     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2008.04.028     Document Type: Article

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