Methanol vinylation mechanism in the KOH/DMSO/CH3 OH/C2 H2 system
Publication type: Journal Article
Publication date: 2010-06-02
scimago Q3
wos Q2
SJR: 0.384
CiteScore: 4.8
Impact factor: 2.0
ISSN: 00207608, 1097461X
Physical and Theoretical Chemistry
Atomic and Molecular Physics, and Optics
Condensed Matter Physics
Abstract
The reaction mechanism of methanol vinylation with acetylene involving a nondissociated KOH molecule was studied using the MP2/6-311++G**//HF/6-31+G* approach with the DMSO molecule explicitly included into reaction system. The whole conversion cycle of methanol vinylation including active nucleophile generation, bonding of the latter to the acetylene moiety yielding an intermediate carbanion, final methyl vinyl ether formation, and potassium hydroxide regeneration could be realized in the coordination shell of nondissociated KOH. © 2010 Wiley Periodicals, Inc. Int J Quantum Chem, 2011
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25
Total citations:
25
Citations from 2024:
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(20%)
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GOST
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Vitkovskaya N. et al. Methanol vinylation mechanism in the KOH/DMSO/CH3 OH/C2 H2 system // International Journal of Quantum Chemistry. 2010. Vol. 111. No. 11. pp. 2519-2524.
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Vitkovskaya N., Larionova E. Yu., Kobychev V., Kaempf N. V., Trofimov B. A. Methanol vinylation mechanism in the KOH/DMSO/CH3 OH/C2 H2 system // International Journal of Quantum Chemistry. 2010. Vol. 111. No. 11. pp. 2519-2524.
Cite this
RIS
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TY - JOUR
DO - 10.1002/qua.22643
UR - https://doi.org/10.1002/qua.22643
TI - Methanol vinylation mechanism in the KOH/DMSO/CH3 OH/C2 H2 system
T2 - International Journal of Quantum Chemistry
AU - Vitkovskaya, Nadezhda
AU - Larionova, Elena Yu
AU - Kobychev, Vladimir
AU - Kaempf, Natalia V
AU - Trofimov, B. A.
PY - 2010
DA - 2010/06/02
PB - Wiley
SP - 2519-2524
IS - 11
VL - 111
SN - 0020-7608
SN - 1097-461X
ER -
Cite this
BibTex (up to 50 authors)
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@article{2010_Vitkovskaya,
author = {Nadezhda Vitkovskaya and Elena Yu Larionova and Vladimir Kobychev and Natalia V Kaempf and B. A. Trofimov},
title = {Methanol vinylation mechanism in the KOH/DMSO/CH3 OH/C2 H2 system},
journal = {International Journal of Quantum Chemistry},
year = {2010},
volume = {111},
publisher = {Wiley},
month = {jun},
url = {https://doi.org/10.1002/qua.22643},
number = {11},
pages = {2519--2524},
doi = {10.1002/qua.22643}
}
Cite this
MLA
Copy
Vitkovskaya, Nadezhda, et al. “Methanol vinylation mechanism in the KOH/DMSO/CH3 OH/C2 H2 system.” International Journal of Quantum Chemistry, vol. 111, no. 11, Jun. 2010, pp. 2519-2524. https://doi.org/10.1002/qua.22643.
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