Electrostatic Potential Minimum of the Aromatic Ring as a Measure of Substituent Constant-Reference-Cited by-同舟云学术

Electrostatic Potential Minimum of the Aromatic Ring as a Measure of Substituent Constant

Published:2007-01-06 Issue:4 Volume:111 Page:710-714
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Suresh Cherumuttathu H.¹,Gadre Shridhar R.¹

Affiliation:

1. Computational Modeling and Simulation Section, Regional Research Laboratory (CSIR), Trivandrum 695 019, India and Department of Chemistry, University of Pune, Pune 411 007, India

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp066917n

Reference25 articles.

1. Electronic Perturbations of the Aromatic Nucleus: Hammett Constants and Electrostatic Potential Topography

2. A Novel Electrostatic Approach to Substituent Constants: Doubly Substituted Benzenes

3. Molecular Electrostatic Potential as Reactivity Index in Hydrogen Bonding: Ab Initio Molecular Orbital Study of Complexes of Nitrile and Carbonyl Compounds with Hydrogen Fluoride

4. Ab Initio Molecular-Orbital Study of Hydrogen-Bonded Complexes of Carbonyl Aliphatic Compounds and Hydrogen Fluoride

5. An Efficient Computational Approach for the Evaluation of Substituent Constants

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