Ab initio calculations of substituent constants: a reinvestigation-Reference-Cited by-同舟云学术

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Ab initio calculations of substituent constants: a reinvestigation

Published:1997-06 Issue:1-3 Volume:397 Page:231-238
ISSN:0166-1280
Container-title:Journal of Molecular Structure: THEOCHEM
language:en
Short-container-title:Journal of Molecular Structure: THEOCHEM

Author:

Exner Otto,Ingr Marek,Čársky Petr

Funder

Grantová Agentura České Republiky

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry

Reference37 articles.

1. Correlation Analysis of Chemical Data;Exner,1988

2. The Role of meta and para Benzene Derivatives in the Evaluation of Substituent Effects: a Multivariate Data Analysis.

3. Theoretical studies of the inductive effect. IV. A theoretical scale of substituent field parameters

4. A theoretical scale of substituent resonance parameters (σR°)

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1. Most of the field/inductive substituent effect works through the bonds;Journal of Molecular Modeling;2019-11-19

2. Quantification and classification of substituent effects in organic chemistry: a theoretical molecular electrostatic potential study;Physical Chemistry Chemical Physics;2016

3. Electronic effect of ionic-pair substituents;Journal of Physical Organic Chemistry;2013-03-24

4. Hydrogen-Bond Accepting Strength of Five-Membered N-Heterocycles:The Case of Substituted Phenylpyrrolines and Myosmines;European Journal of Organic Chemistry;2009-10

5. Bibliography;Molecular Descriptors for Chemoinformatics;2009-07-15

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