Abstract:
According to quantum chemical calculations, the interaction of a thermally stable Auiii hydride complex with H2O2 leads to the formation of an Auiii hydroxyl complex in one stage with a low activation barrier and a significant energy decrease.
Document Type:
Article
Language: English
Citation:
N. G. Nikitenko, A. F. Shestakov, “Quantum-chemical modeling of the oxidation of Auiii hydride complexes by hydrogen peroxide”, Mendeleev Commun., 27:2 (2017), 144–146
Linking options:
https://www.mathnet.ru/eng/mendc1924
https://www.mathnet.ru/eng/mendc/v27/i2/p144
This publication is cited in the following 3 articles:
S. A. Golovanova, A. P. Sadkov, A. F. Shestakov, “Oxidation of methane to methanol with hydrogen peroxide in situ in the presence of glutathione-stabilized gold nanoclusters under mild conditions”, Russ Chem Bull, 71:4 (2022), 665
N. G. Nikitenko, A. F. Shestakov, “H–D exchange between quercetin and solvent in the presence of AuI chloride complexes with DMSO: quantum chemical modeling”, Russ Chem Bull, 67:10 (2018), 1794
Ya. B. Platonova, A. S. Morozov, I. D. Burtsev, Yu. S. Korostei, V. Yu. Ionidi, B. V. Romanovsky, L. G. Tomilova, “Oxidation of phenol catalyzed by immobilized phthalocyanine complexes”, Mendeleev Commun., 28:2 (2018), 198–199
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