Relativistic effects on the aromaticity of E3M3H3 (E = C–Pb; M = N–Bi) benzene analogues-Reference-Cited by-同舟云学术

Relativistic effects on the aromaticity of E3M3H3 (E = C–Pb; M = N–Bi) benzene analogues

Published:2020 Issue:40 Volume:22 Page:22973-22978
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Pino-Rios Ricardo¹²³⁴⁵^ORCID,Vásquez-Espinal Alejandro⁶⁷⁸⁹⁵^ORCID,Alvarez-Thon Luis¹⁰¹¹¹²¹³,Tiznado William⁶⁷⁸⁹⁵^ORCID

Affiliation:

1. Laboratorio de Química Teórica

2. Facultad de Química y Biología

3. Universidad de Santiago de Chile (USACH)

4. Av. Libertador Bernardo O’Higgins

5. Santiago

6. Computational and Theoretical Chemistry Group

7. Departamento de Ciencias Químicas

8. Facultad de Ciencias Exactas

9. Universidad Andres Bello

10. Facultad de Ingeniería

11. Universidad Central de Chile

12. Toesca

13. Chile

Abstract

The relativistic effects on the aromaticity of a set of benzene analogues, E₃M₃H₃ (E = C–Pb; M = N–Bi) heterocycles, using magnetically induced current density (MICD) and the NICS_zz component of the conventional nucleus independent chemical shift (NICS), is hereby examined.

Funder

Fondo Nacional de Desarrollo Científico y Tecnológico

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP04446F

Reference77 articles.

1. Introduction: Aromaticity

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