M. R. Radzhabov, D. V. Tsyganov, T. S. Pivina, M. M. Krayushkin, N. Seeboth, S. Ivanov, A.-F. Salit, “Synthesis of pyridinium ylides and simulation of their 1,3-dipolar cycloaddition mechanism”, Mendeleev Commun., 2017, Volume 27, Issue 5,Pages <nobr>503

This article is cited in 6 papers

Communications

Synthesis of pyridinium ylides and simulation of their 1,3-dipolar cycloaddition mechanism

M. R. Radzhabov^ab, D. V. Tsyganov^a, T. S. Pivina^a, M. M. Krayushkin^a, N. Seeboth^c, S. Ivanov^c, A.-F. Salit^c

^a N.D. Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russian Federation
^b Higher Chemical College of the Russian Academy of Sciences, D.I. Mendeleev University of Chemical Technology of Russia, Moscow, Russian Federation
^c Manufacture Française des Pneumatiques Michelin, Clermont-Ferrand Cedex, France

Abstract: Synthesis of some pyridinium ylides with different 4-R-phenyl substituents (R = H, MeO, Me, NO₂, F) has been performed. Quantum-chemical calculations on the spatial and electronic structure, as well as the modeling of 1,3-dipolar cycloadddition reaction of these compounds have been carried out. The results of computer modeling are in good agreement with the results of the synthesis of these compounds.

Language: English

DOI: 10.1016/j.mencom.2017.09.025

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