How great is the stabilization of crowded polyphenylbiphenyls by London dispersion?-Reference-Cited by-同舟云学术

How great is the stabilization of crowded polyphenylbiphenyls by London dispersion?

Published:2023 Issue:19 Volume:25 Page:13359-13375
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

R. A. C. Lima Carlos F.¹^ORCID,Mague Joel T.²^ORCID,Du Yuchen²,Pascal Robert A.²^ORCID,Santos Luís M. N. B. F.¹^ORCID

Affiliation:

1. CIQUP, Institute of Molecular Sciences (IMS), Departamento de Química e Bioquímica, Faculdade de Ciências, Universidade do Porto, rua do Campo Alegre s/n, 4169-007 Porto, Portugal

2. Department of Chemistry, Tulane University, New Orleans, LA 70118, USA

Abstract

Energetic analyses based on homodesmotic reactions show a surprising ability of crowded biphenyls to achieve significant stabilization through intramolecular dispersive interactions, which is underestimated even by state-of-the-art DFT calculations.

Funder

National Science Foundation

Fundação para a Ciência e a Tecnologia

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2023/CP/D2CP05085D

Reference77 articles.

1. Bistetracyclones and Bishexaphenylbenzenes. II

2. Polyphenylbiphenyls and Polyphenylfluorenes

3. Extremely Crowded Biaryls

4. The Pursuit of Perphenylterphenyls

5. Conformational subtlety in large polyphenylene molecules

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