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On the Electrophilic Character of Molecules Through Its Relation with Electronegativity and Chemical Hardness

Electrophilicity is an intrinsic property of atoms and molecules. It probably originates logistically with the involvement in the physical process of electrostatics of soaked charge in electronic shells and the screened nuclear charge of atoms. Motivated by the existing view of conceptual density fu...

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Detalles Bibliográficos
Autores principales: Islam, Nazmul, Ghosh, Dulal C.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Molecular Diversity Preservation International (MDPI) 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3292014/
https://www.ncbi.nlm.nih.gov/pubmed/22408445
http://dx.doi.org/10.3390/ijms13022160
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author Islam, Nazmul
Ghosh, Dulal C.
author_facet Islam, Nazmul
Ghosh, Dulal C.
author_sort Islam, Nazmul
collection PubMed
description Electrophilicity is an intrinsic property of atoms and molecules. It probably originates logistically with the involvement in the physical process of electrostatics of soaked charge in electronic shells and the screened nuclear charge of atoms. Motivated by the existing view of conceptual density functional theory that similar to electronegativity and hardness equalization, there should be a physical process of equalization of electrophilicity during the chemical process of formation of hetero nuclear molecules, we have developed a new theoretical scheme and formula for evaluating the electrophilicity of hetero nuclear molecules. A comparative study with available bench marking reveals that the hypothesis of electrophilicity and equalization, and the present method of evaluating equalized electrophilicity, are scientifically promising.
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spelling pubmed-32920142012-03-09 On the Electrophilic Character of Molecules Through Its Relation with Electronegativity and Chemical Hardness Islam, Nazmul Ghosh, Dulal C. Int J Mol Sci Article Electrophilicity is an intrinsic property of atoms and molecules. It probably originates logistically with the involvement in the physical process of electrostatics of soaked charge in electronic shells and the screened nuclear charge of atoms. Motivated by the existing view of conceptual density functional theory that similar to electronegativity and hardness equalization, there should be a physical process of equalization of electrophilicity during the chemical process of formation of hetero nuclear molecules, we have developed a new theoretical scheme and formula for evaluating the electrophilicity of hetero nuclear molecules. A comparative study with available bench marking reveals that the hypothesis of electrophilicity and equalization, and the present method of evaluating equalized electrophilicity, are scientifically promising. Molecular Diversity Preservation International (MDPI) 2012-02-17 /pmc/articles/PMC3292014/ /pubmed/22408445 http://dx.doi.org/10.3390/ijms13022160 Text en © 2012 by the authors; licensee Molecular Diversity Preservation International, Basel, Switzerland. http://creativecommons.org/licenses/by/3.0 This article is an open-access article distributed under the terms and conditions of the Creative Commons Attribution license (http://creativecommons.org/licenses/by/3.0/).
spellingShingle Article
Islam, Nazmul
Ghosh, Dulal C.
On the Electrophilic Character of Molecules Through Its Relation with Electronegativity and Chemical Hardness
title On the Electrophilic Character of Molecules Through Its Relation with Electronegativity and Chemical Hardness
title_full On the Electrophilic Character of Molecules Through Its Relation with Electronegativity and Chemical Hardness
title_fullStr On the Electrophilic Character of Molecules Through Its Relation with Electronegativity and Chemical Hardness
title_full_unstemmed On the Electrophilic Character of Molecules Through Its Relation with Electronegativity and Chemical Hardness
title_short On the Electrophilic Character of Molecules Through Its Relation with Electronegativity and Chemical Hardness
title_sort on the electrophilic character of molecules through its relation with electronegativity and chemical hardness
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3292014/
https://www.ncbi.nlm.nih.gov/pubmed/22408445
http://dx.doi.org/10.3390/ijms13022160
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