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Mendeleev Communications, 2019, Volume 29, Issue 3, Pages 343–345
DOI: https://doi.org/10.1016/j.mencom.2019.05.035
(Mi mendc1518)
 

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

Communications

DFT B3LYP/6-311+G* calculation study of a new nonclassical mechanism of electrophilic functionalization of aromatic C–H bond via aryl cation formation

Yu. A. Borisov, I. S. Akhrem

A.N. Nesmeyanov Institute of Organoelement Compounds of Russian Academy of Sciences, Moscow, Russian Federation
Abstract: The DFT B3LYP-/6-311+G* calculations of the reactions beween 1,3,5-Ad3C6H3 (Ad=1-adamantyl) and CBr3+Al2Br7 with or without CO reveal that only sp3 C–H route occurs.
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Document Type: Article
Language: English
Supplementary materials:
Supplementary_data_1.pdf (1.2 Mb)


Citation: Yu. A. Borisov, I. S. Akhrem, “DFT B3LYP/6-311+G* calculation study of a new nonclassical mechanism of electrophilic functionalization of aromatic C–H bond via aryl cation formation”, Mendeleev Commun., 29:3 (2019), 343–345
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  • https://www.mathnet.ru/eng/mendc/v29/i3/p343
  • This publication is cited in the following 4 articles:
    Citing articles in Google Scholar: Russian citations, English citations
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