Quantum chemical study of the autoxidation of ascorbate.

Herrmann, Nils; Heinz, Norah; Dolg, Michael; Cao, Xiaoyan

Herrmann, Nils; Heinz, Norah; Dolg, Michael; Cao, Xiaoyan.

Afiliação

Herrmann N; Department of Chemistry, Institute for Theoretical Chemistry, University of Cologne, Greinstr. 4, Cologne, 50939, Germany.
Heinz N; Department of Chemistry, Institute for Theoretical Chemistry, University of Cologne, Greinstr. 4, Cologne, 50939, Germany.
Dolg M; Department of Chemistry, Institute for Theoretical Chemistry, University of Cologne, Greinstr. 4, Cologne, 50939, Germany.
Cao X; Department of Chemistry, Institute for Theoretical Chemistry, University of Cologne, Greinstr. 4, Cologne, 50939, Germany.

J Comput Chem ; 37(20): 1914-23, 2016 07.

Article em En | MEDLINE | ID: mdl-27316823

Palavras-chave

ascorbate; ascorbic acid; autoxidation; coupled cluster theory; density functional theory; electron affinity; ionization potential; motexafin gadolinium; texaphyrin

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: J Comput Chem Assunto da revista: QUIMICA Ano de publicação: 2016 Tipo de documento: Article País de afiliação: Alemanha

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