Abstract
In the framework of semiempirical quantum chemical MINDO/3 method the selective oxidation of ethane to acetaldehyde on a specially modified boron - phosphorus mixed oxide catalyst has been considered. On the basis of the results of calculation a possible mechanism for this process is proposed.
Original language | English |
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Pages (from-to) | 301-308 |
Number of pages | 8 |
Journal | Reaction Kinetics & Catalysis Letters |
Volume | 48 |
Issue number | 1 |
DOIs | |
Publication status | Published - 1992 Jul 1 |
Externally published | Yes |
ASJC Scopus subject areas
- Catalysis
- Physical and Theoretical Chemistry