Is coronene better described by Clar's aromatic π-sextet model or by the AdNDP representation?-Reference-Cited by-同舟云学术

Is coronene better described by Clar's aromatic π-sextet model or by the AdNDP representation?

Published:2017-04-10 Issue:18 Volume:38 Page:1606-1611
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J. Comput. Chem.

Author:

Kumar Anand¹²,Duran Miquel²,Solà Miquel²^ORCID

Affiliation:

1. Department of Chemistry; Indian Institute of Science Education and Research; Pune, Dr. Homi Bhabha Road Pune Maharashtra 411008 India

2. Institut de Química Computacional i Catàlisi (IQCC), Department de Química; Universitat de Girona; c/Maria Aurèlia Capmany 6 Girona Catalonia 17003 Spain

Funder

Ministerio de Economía y Competitividad

Generalitat de Catalunya

European Fund for Regional Development (FEDER

Department of Science & Technology, India (INSPIRE fellowship to A.K.)

Infosys Foundation (Infosys Foundation fellowship to A.K.)

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Reference103 articles.

1. What is aromaticity?

2. Aromaticity: a Theoretical Concept of Immense Practical Importance

3. Introduction: Aromaticity

4. Introduction: DelocalizationPi and Sigma

5. Challenges in aromaticity: 150 years after Kekulé's benzene

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