Impact of fluorination and chlorination on the electronic structure, topology and in-plane ring normal modes of pyridines-Reference-Cited by-同舟云学术

Impact of fluorination and chlorination on the electronic structure, topology and in-plane ring normal modes of pyridines

Published:2021 Issue:34 Volume:23 Page:18958-18974
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Benassi Enrico¹^ORCID,Vaganova Tamara²^ORCID,Malykhin Evgenij²^ORCID,Fan Haiyan³^ORCID

Affiliation:

1. Novosibirsk State University, Novosibirsk, 630090, Russia

2. Vorozhtsov Novosibirsk Institute of Organic Chemistry SB RAS, Novosibirsk, 630090, Russia

3. Department of Chemistry, School of Sciences and Humanities, Nazarbayev University Nazarbayev University, Nursultan, 010000, Kazakhstan

Abstract

7 halogenated pyridines are investigated through FTIR and Raman spectroscopy and quantum calculations. A rationale on the effects of nature and position of substituents on the ring normal modes’ wavenumbers and other molecular properties is proposed.

Funder

Nazarbayev University

Ministry of Education and Science of the Russian Federation

Russian Academy of Sciences

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2021/CP/D1CP02342J

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1. Fluorine in medicinal chemistry: A review of anti-cancer agents