Cooperative effects between π-hole triel and π-hole chalcogen bonds
Author:
Affiliation:
1. The Laboratory of Theoretical and Computational Chemistry
2. School of Chemistry and Chemical Engineering
3. Yantai University
4. Yantai 264005
5. People's Republic of China
Abstract
MP2/aug-cc-pVTZ calculations have been performed on π-hole triel- and chalcogen-bonded complexes involving a heteroaromatic compound. Both interactions exhibit cooperative/diminutive effect, depending on the role of the central heteroaromatic compound.
Funder
National Natural Science Foundation of China
Publisher
Royal Society of Chemistry (RSC)
Subject
General Chemical Engineering,General Chemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2018/RA/C8RA04106G
Reference78 articles.
1. S.Scheiner , Hydrogen Bonding: A Theoretical Perspective , Oxford University Press , Oxford , 1997
2. G. A.Jeffrey , An Introduction to Hydrogen Bonding , Oxford University Press , New York , 1997
3. G. R.Desiraju and T.Steiner , The Weak Hydrogen Bond , Oxford University Press , Oxford, United Kingdom , 1999
4. Origin of the Catalytic Effects of Molecular Iodine: A Computational Analysis
5. Statistical and Theoretical Investigations on the Directionality of Nonbonded S···O Interactions. Implications for Molecular Design and Protein Engineering
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