Synthesis and computationally assisted spectroscopic study of tautomerism in 3-(phenyl(2-arylhydrazineylidene)methyl)quinoxalin-2(1H)-ones

Author:

Katsyuba Sergey A.1ORCID,Mustakimova Liliya V.1ORCID,Gerasimova Tatiana P.1ORCID,Burganov Timur I.1ORCID,Sirazieva Aisylu R.1,Voronina Julia K.1ORCID,Shamsutdinova Leisan R.1,Rizvanov Il’dar Kh.1ORCID,Mamedov Vakhid A.1ORCID

Affiliation:

1. Arbuzov Institute of Organic and Physical Chemistry, FRC Kazan Scientific Center of RAS, Arbuzov st. 8, 420088 Kazan, Russia

Abstract

Implicit and explicit quantum mechanical modeling of solutions of a series of quinoxalinone-based hydrazones allowed to describe their tautomeric/isomeric/conformational composition and IR and UV-Vis spectra.

Funder

Russian Science Foundation

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry,Catalysis

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