On the Nature of Radicals Formed in Methanol Catalytic Oxidation Full article
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Kinetics and Catalysis
ISSN: 0023-1584 , E-ISSN: 1608-3210 |
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| Output data | Year: 2009, Volume: 50, Number: 4, Pages: 583-586 Pages count : 4 DOI: 10.1134/S0023158409040168 | ||||
| Tags | Methanol Oxidation; Methoxyl; Hydroxymethyl Radical; GAUSSIAN Program; Direct Photolysis | ||||
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Abstract:
The quantum-chemical calculations of the hydroxymethyl radical •CH2OH were performed for the first time and a theoretical EPR spectrum of this radical was constructed. The formation of the hydroxymethyl radical in the reaction of methanol oxidation is thermodynamically favorable. The shape and parameters of the constructed spectrum differed from those for radicals experimentally detected in the catalytic oxidation of methanol using the matrix isolation method. However, they are consistent with the spectrum ascribed to the EPR spectrum of •CH2OH observed in the direct photolysis of methanol. This result allows one to refine the identification of the nature of radicals formed in the catalytic reaction of methanol oxidation.
Cite:
Malakhova I.V.
, Shubin A.A.
On the Nature of Radicals Formed in Methanol Catalytic Oxidation
Kinetics and Catalysis. 2009. V.50. N4. P.583-586. DOI: 10.1134/S0023158409040168 WOS Scopus РИНЦ ANCAN OpenAlex
On the Nature of Radicals Formed in Methanol Catalytic Oxidation
Kinetics and Catalysis. 2009. V.50. N4. P.583-586. DOI: 10.1134/S0023158409040168 WOS Scopus РИНЦ ANCAN OpenAlex
Original:
Малахова И.В.
, Шубин А.А.
О природе радикалов, образующихся в реакции каталитического окисления метанола
Кинетика и катализ. 2009. Т.50. №4. С.605-607. РИНЦ
О природе радикалов, образующихся в реакции каталитического окисления метанола
Кинетика и катализ. 2009. Т.50. №4. С.605-607. РИНЦ
Dates:
| Submitted: | Sep 1, 2008 |
| Published print: | Jul 1, 2009 |
| Published online: | Aug 25, 2009 |
Identifiers:
| Web of science: | WOS:000269253900016 |
| Scopus: | 2-s2.0-69249129373 |
| Elibrary: | 15294413 |
| Chemical Abstracts: | 2009:1026763 |
| Chemical Abstracts (print): | 152:429125 |
| OpenAlex: | W1964396349 |