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Mendeleev Communications, 2011, Volume 21, Issue 6, Pages 305–306
DOI: https://doi.org/10.1016/j.mencom.2011.11.003
(Mi mendc2952)
 

This article is cited in 4 scientific papers (total in 4 papers)

Ab initio MP2 study of the reaction mechanisms of C2 with halogens and hydrohalides

Yu. A. Kolbanovskiia, Yu. A. Borisovb

a A.V. Topchiev Institute of Petrochemical Synthesis, Russian Academy of Sciences, Moscow, Russian Federation
b A.N. Nesmeyanov Institute of Organoelement Compounds of Russian Academy of Sciences, Moscow, Russian Federation
Full-text PDF (351 kB) Citations (4)
Abstract: The ab initio MP2 method was used to calculate the activation energy of vinylidene and its derivatives formation, and their decisive role in the detailed mechanism of C2 (X1Σ+G) reactions with halogen and hydrohalide molecules was shown.
Document Type: Article
Language: English
Supplementary materials:
Supplementary_data_1.pdf (45.0 Kb)


Citation: Yu. A. Kolbanovskii, Yu. A. Borisov, “Ab initio MP2 study of the reaction mechanisms of C2 with halogens and hydrohalides”, Mendeleev Commun., 21:6 (2011), 305–306
Linking options:
  • https://www.mathnet.ru/eng/mendc2952
  • https://www.mathnet.ru/eng/mendc/v21/i6/p305
  • This publication is cited in the following 4 articles:
    1. Yu. A. Kolbanovskii, Yu. A. Borisov, “Quantum chemical calculations on the mechanism of the reaction between dicarbene C2(X 1Σ G + ) and molecular nitrogen”, Russ. J. Phys. Chem. B, 9:1 (2015), 29  crossref
    2. E. Gras, S. Chassaing, Organic Reaction Mechanisms Series, Organic Reaction Mechanisms 2011, 2014, 199  crossref
    3. Yu. A. Kolbanovskii, A. M. Tsedilin, Yu. A. Borisov, “A theoretical study of the role of carbenes in the kinetics and mechanism of the reactions of synthesis and pyrolysis of carbon suboxide”, Russ. J. Phys. Chem. B, 8:6 (2014), 829  crossref
    4. N. N. Buravtsev, Yu. A. Kolbanovskii, Yu. A. Borisov, “Kinetics and mechanism of the stereospecific dimerization of trifluoromethylfluorocarbene”, Russ. J. Phys. Chem. B, 7:2 (2013), 127  crossref
    Citing articles in Google Scholar: Russian citations, English citations
    Related articles in Google Scholar: Russian articles, English articles
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