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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...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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Molecular Diversity Preservation International (MDPI)
2012
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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. |
format | Online Article Text |
id | pubmed-3292014 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | Molecular Diversity Preservation International (MDPI) |
record_format | MEDLINE/PubMed |
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 |
work_keys_str_mv | AT islamnazmul ontheelectrophiliccharacterofmoleculesthroughitsrelationwithelectronegativityandchemicalhardness AT ghoshdulalc ontheelectrophiliccharacterofmoleculesthroughitsrelationwithelectronegativityandchemicalhardness |