Toward Selection of Efficient Density Functionals for van der Waals Molecular Complexes: Comparative Study of C–H···π and N–H···π Interactions-Reference-Cited by-同舟云学术

Toward Selection of Efficient Density Functionals for van der Waals Molecular Complexes: Comparative Study of C–H···π and N–H···π Interactions

Published:2015-02-06 Issue:7 Volume:119 Page:1190-1200
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Paytakov Guvanchmyrat¹,Dinadayalane Tandabany²,Leszczynski Jerzy¹

Affiliation:

1. Interdisciplinary Center for Nanotoxicity, Department of Chemistry and Biochemistry, Jackson State University, J. R. Lynch Street, Jackson, Mississippi 39217, United States

2. Department of Chemistry, Clark Atlanta University, 223 James P. Brawley Drive, S.W., Atlanta, Georgia 30314, United States

Funder

National Science Foundation

Division of Human Resource Development

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp511450u

Reference60 articles.

1. Benzene⋯acetylene: a structural investigation of the prototypical CH⋯π interaction

2. A Molecular Cluster Study on Activated CH/π Interactions: Infrared Spectroscopy of Aromatic Molecule−Acetylene Clusters

3. N–H⋯π interactions in pyrroles: systematic trends from the vibrational spectroscopy of clusters

4. AH⋯π hydrogen bonding to acetylene and benzene: The role of intramolecular coupling

5. Understanding of Assembly Phenomena by Aromatic−Aromatic Interactions: Benzene Dimer and the Substituted Systems

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