Competition and Interplay between σ-Hole and π-Hole Interactions: A Computational Study of 1:1 and 1:2 Complexes of Nitryl Halides (O2NX) with Ammonia-Reference-Cited by-同舟云学术

Competition and Interplay between σ-Hole and π-Hole Interactions: A Computational Study of 1:1 and 1:2 Complexes of Nitryl Halides (O2NX) with Ammonia

Published:2012-05-16 Issue:21 Volume:116 Page:5199-5206
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Solimannejad Mohammad¹,Ramezani Vahid¹,Trujillo Cristina²,Alkorta Ibon²,Sánchez-Sanz Goar²,Elguero José²

Affiliation:

1. Quantum Chemistry Group, Department of Chemistry, Faculty of Sciences, Arak University, Arak 38156-8-8349, Iran

2. Instituto de Química Médica (CSIC), Juan de la Cierva, 3, 28006 Madrid, Spain

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp300540z

Reference47 articles.

1. Noncovalent Interactions: A Challenge for Experiment and Theory

2. Halogen bonding: the σ-hole

3. Halogen bonds in biological molecules

4. An overview of halogen bonding

5. A predicted new type of directional noncovalent interaction

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