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Ionocovalency and Applications 1. Ionocovalency Model and Orbital Hybrid Scales
Ionocovalency (IC), a quantitative dual nature of the atom, is defined and correlated with quantum-mechanical potential to describe quantitatively the dual properties of the bond. Orbiotal hybrid IC model scale, IC, and IC electronegativity scale, X(IC), are proposed, wherein the ionicity and the co...
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Formato: | Texto |
Lenguaje: | English |
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Molecular Diversity Preservation International (MDPI)
2010
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3000088/ https://www.ncbi.nlm.nih.gov/pubmed/21151444 http://dx.doi.org/10.3390/ijms11114381 |
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author | Zhang, Yonghe |
author_facet | Zhang, Yonghe |
author_sort | Zhang, Yonghe |
collection | PubMed |
description | Ionocovalency (IC), a quantitative dual nature of the atom, is defined and correlated with quantum-mechanical potential to describe quantitatively the dual properties of the bond. Orbiotal hybrid IC model scale, IC, and IC electronegativity scale, X(IC), are proposed, wherein the ionicity and the covalent radius are determined by spectroscopy. Being composed of the ionic function I and the covalent function C, the model describes quantitatively the dual properties of bond strengths, charge density and ionic potential. Based on the atomic electron configuration and the various quantum-mechanical built-up dual parameters, the model formed a Dual Method of the multiple-functional prediction, which has much more versatile and exceptional applications than traditional electronegativity scales and molecular properties. Hydrogen has unconventional values of IC and X(IC), lower than that of boron. The IC model can agree fairly well with the data of bond properties and satisfactorily explain chemical observations of elements throughout the Periodic Table. |
format | Text |
id | pubmed-3000088 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | Molecular Diversity Preservation International (MDPI) |
record_format | MEDLINE/PubMed |
spelling | pubmed-30000882010-12-10 Ionocovalency and Applications 1. Ionocovalency Model and Orbital Hybrid Scales Zhang, Yonghe Int J Mol Sci Article Ionocovalency (IC), a quantitative dual nature of the atom, is defined and correlated with quantum-mechanical potential to describe quantitatively the dual properties of the bond. Orbiotal hybrid IC model scale, IC, and IC electronegativity scale, X(IC), are proposed, wherein the ionicity and the covalent radius are determined by spectroscopy. Being composed of the ionic function I and the covalent function C, the model describes quantitatively the dual properties of bond strengths, charge density and ionic potential. Based on the atomic electron configuration and the various quantum-mechanical built-up dual parameters, the model formed a Dual Method of the multiple-functional prediction, which has much more versatile and exceptional applications than traditional electronegativity scales and molecular properties. Hydrogen has unconventional values of IC and X(IC), lower than that of boron. The IC model can agree fairly well with the data of bond properties and satisfactorily explain chemical observations of elements throughout the Periodic Table. Molecular Diversity Preservation International (MDPI) 2010-11-03 /pmc/articles/PMC3000088/ /pubmed/21151444 http://dx.doi.org/10.3390/ijms11114381 Text en © 2010 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 Zhang, Yonghe Ionocovalency and Applications 1. Ionocovalency Model and Orbital Hybrid Scales |
title | Ionocovalency and Applications 1. Ionocovalency Model and Orbital Hybrid Scales |
title_full | Ionocovalency and Applications 1. Ionocovalency Model and Orbital Hybrid Scales |
title_fullStr | Ionocovalency and Applications 1. Ionocovalency Model and Orbital Hybrid Scales |
title_full_unstemmed | Ionocovalency and Applications 1. Ionocovalency Model and Orbital Hybrid Scales |
title_short | Ionocovalency and Applications 1. Ionocovalency Model and Orbital Hybrid Scales |
title_sort | ionocovalency and applications 1. ionocovalency model and orbital hybrid scales |
topic | Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3000088/ https://www.ncbi.nlm.nih.gov/pubmed/21151444 http://dx.doi.org/10.3390/ijms11114381 |
work_keys_str_mv | AT zhangyonghe ionocovalencyandapplications1ionocovalencymodelandorbitalhybridscales |