A quantum-chemical study of adsorbed nonclassical carbonium ions as active intermediates in catalytic transformations of paraffins. I. Protolytic cracking of ethane on high silica zeolites
Тип публикации: Journal Article
Дата публикации: 1994-09-01
SCImago Q2
WOS Q3
БС2
SJR: 0.461
CiteScore: 4.9
Impact factor: 2.5
ISSN: 1011372X, 1572879X
General Chemistry
Catalysis
Краткое описание
Ab initio quantum-chemical calculations of protolytic cracking of ethane on Brønsted acid sites of high silica zeolites demonstrated the concerted mechanism of this reaction. The reaction coordinate represents the stretching of the O-H bond in combination with heterolytic splitting of the C-C ethane bond. This results in formation of methane and adsorption of the methyl group on the surface basic oxygen of the active site. The geometry of such activated complex is different from that of adsorbed carbonium ions which also represent highly excited surface complexes
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Kazansky V. et al. A quantum-chemical study of adsorbed nonclassical carbonium ions as active intermediates in catalytic transformations of paraffins. I. Protolytic cracking of ethane on high silica zeolites // Catalysis Letters. 1994. Vol. 27. No. 3-4. pp. 345-354.
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Kazansky V., Senchenya I. N., Frash M., van Santen R. A. A quantum-chemical study of adsorbed nonclassical carbonium ions as active intermediates in catalytic transformations of paraffins. I. Protolytic cracking of ethane on high silica zeolites // Catalysis Letters. 1994. Vol. 27. No. 3-4. pp. 345-354.
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TY - JOUR
DO - 10.1007/bf00813921
UR - https://doi.org/10.1007/bf00813921
TI - A quantum-chemical study of adsorbed nonclassical carbonium ions as active intermediates in catalytic transformations of paraffins. I. Protolytic cracking of ethane on high silica zeolites
T2 - Catalysis Letters
AU - Kazansky, V.B
AU - Senchenya, I N
AU - Frash, M
AU - van Santen, R. A.
PY - 1994
DA - 1994/09/01
PB - Springer Nature
SP - 345-354
IS - 3-4
VL - 27
SN - 1011-372X
SN - 1572-879X
ER -
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BibTex (до 50 авторов)
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@article{1994_Kazansky,
author = {V.B Kazansky and I N Senchenya and M Frash and R. A. van Santen},
title = {A quantum-chemical study of adsorbed nonclassical carbonium ions as active intermediates in catalytic transformations of paraffins. I. Protolytic cracking of ethane on high silica zeolites},
journal = {Catalysis Letters},
year = {1994},
volume = {27},
publisher = {Springer Nature},
month = {sep},
url = {https://doi.org/10.1007/bf00813921},
number = {3-4},
pages = {345--354},
doi = {10.1007/bf00813921}
}
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MLA
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Kazansky, V.B, et al. “A quantum-chemical study of adsorbed nonclassical carbonium ions as active intermediates in catalytic transformations of paraffins. I. Protolytic cracking of ethane on high silica zeolites.” Catalysis Letters, vol. 27, no. 3-4, Sep. 1994, pp. 345-354. https://doi.org/10.1007/bf00813921.
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