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JOURNALS // Mendeleev Communications // Archive

Mendeleev Commun., 1997 Volume 7, Issue 5, Pages 169–171 (Mi mendc4839)

This article is cited in 12 papers

A theoretical study of the formation and destruction of the aci-forms of nitromethane and dinitromethane

G. M. Khrapkovskiia, A. G. Shamova, G. A. Shamova, V. A. Shlyapochnikovb

a Kazan National Research Technological University, Kazan, Russian Federation
b N.D. Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russian Federation

Abstract: A quantum-chemical study of the dehydration mechanism of CH3NO2 and CH2(NO2)2 molecules has shown that a water molecule eliminates from the respective aci-forms, formation of the latter being the limiting step of the whole process.

Language: English

DOI: 10.1070/MC1997v007n05ABEH000825



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