The aromaticity of verdazyl radicals and their closed-shell charged species-Reference-Cited by-同舟云学术

The aromaticity of verdazyl radicals and their closed-shell charged species

Published:2018 Issue:24 Volume:42 Page:19987-19994
ISSN:1144-0546
Container-title:New Journal of Chemistry
language:en
Short-container-title:New J. Chem.

Author:

Valiev Rashid R.¹²³⁴⁵^ORCID,Drozdova Anna K.¹²³,Petunin Pavel V.⁶⁷³⁸⁷^ORCID,Postnikov Pavel S.⁶⁷³⁹¹⁰^ORCID,Trusova Marina E.⁶⁷³,Cherepanov Victor N.¹²³,Sundholm Dage⁴⁵¹¹¹²^ORCID

Affiliation:

1. Tomsk State University

2. Tomsk

3. Russian Federation

4. Department of Chemistry

5. University of Helsinki

6. Tomsk Polytechnic University

7. Tomsk 634050

8. Siberian State Medical University

9. Department of Solid State Engineering, University of Chemistry and Technology

10. Prague

11. Helsinki FIN-00014

12. Finland

Abstract

The aromaticity of fourteen 3-oxo-verdazyl (1–8) and Kuhn verdazyl (9–14) radicals with different substituents has been investigated computationally using the gauge-including magnetically induced current-density (GIMIC) method.

Funder

Tomsk State University

Ministry of Education and Science of the Russian Federation

Academy of Finland

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry,Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2018/NJ/C8NJ04341H

Reference47 articles.

1. Magnetic edge states and coherent manipulation of graphene nanoribbons