Ontology highlight
ABSTRACT:
SUBMITTER: Munoz G
PROVIDER: S-EPMC9062163 | biostudies-literature | 2019 Mar
REPOSITORIES: biostudies-literature
Munoz G G Gunessee B K BK Bégué D D Bouyssiere B B Baraille I I Vallverdu G G Santos Silva H H
RSC advances 20190326 17
The presence of metalloporphyrins in crude oil has been known for many years. In contrast, their role on the physical-chemical properties is only now beginning to be understood. In this study, we test using high-level <i>ab initio</i> calculations, the hypothesis of a possible redox catalytic activity of vanadium and nickel metalloporphyrins in crude oil, illustrated by the oxidation of methanol to formaldehyde and hydrogen dissociation, respectively. This process which may take place during pet ...[more]