Ab initio study of oxygen atom transfer from hydrogen peroxide to trimethylamine

Authors
Ottolina, G Carrea, G
Citation
G. Ottolina et G. Carrea, Ab initio study of oxygen atom transfer from hydrogen peroxide to trimethylamine, CHEM COMMUN, (18), 2001, pp. 1748-1749
Citations number
20
Categorie Soggetti
Chemistry
Journal title
CHEMICAL COMMUNICATIONS
ISSN journal
13597345 → ACNP
Issue
18
Year of publication
2001
Pages
1748 - 1749
Database
ISI
SICI code
1359-7345(20010921):18<1748:AISOOA>2.0.ZU;2-3
Abstract
Unlike what has been theoretically proposed for ammonia oxidation with hydr ogen peroxide, trimethylamine oxidation occurs with a concerted mechanism, which is favored even when an explicit water molecule is added or continuum solvent (water) is simulated.