Quantification of secondary electrostatic interactions in H-bonded complexes-Reference-Cited by-同舟云学术

Quantification of secondary electrostatic interactions in H-bonded complexes

Published:2022 Issue:30 Volume:24 Page:18124-18132
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Storer Maria Chiara¹^ORCID,Hunter Christopher A.¹^ORCID

Affiliation:

1. Yusuf Hamied Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge CB2 1EW, UK

Abstract

Experimental studies of H-bonded complexes were used to parameterise a computational method for ab initio calculation of H-bond parameters that accurately incorporates the effects of long range secondary electrostatic interactions.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2022/CP/D2CP03004G

Reference45 articles.

1. POLARITY AND IONIZATION FROM THE STANDPOINT OF THE LEWIS THEORY OF VALENCE.

2. The Structure of the Carboxyl Group: I. The Investigation of Formic Acid by the Diffraction of Electrons

3. Hydrogen bonding properties of non-polar solvents

4. Footprinting molecular electrostatic potential surfaces for calculation of solvation energies

5. An infrared study of the hydrogen-bonding specificity of hypoxanthine and other nucleic acid derivatives

Cited by 5 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Solvent effects in anion recognition;Nature Reviews Chemistry;2024-03-06

2. An atomic surface site interaction point description of non-covalent interactions;Chemical Science;2024

3. Polarisation effects on the H-bond acceptor properties of secondary amides;Chemical Science;2023

4. Hydrogen-Bond Donors in Drug Design;Journal of Medicinal Chemistry;2022-10-25

5. The surface site interaction point approach to non-covalent interactions;Chemical Society Reviews;2022