Electronegativity: A continuing enigma

被引:5
作者
Politzer, Peter [1 ]
Murray, Jane S. [1 ]
机构
[1] Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
关键词
average valence electron ionization energies of atoms; chemical potential; electronegativity; DENSITY-FUNCTIONAL THEORY; FRACTIONAL PARTICLE NUMBER; DERIVATIVE DISCONTINUITIES; CONFIGURATION ENERGIES; DEPENDENCE; CHEMISTRY; ELECTRONS; HARDNESS; VALUES; SCALE;
D O I
10.1002/poc.4406
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
There continues to be confusion concerning the concept of electronegativity. Pauling's original approach, focusing upon an atom in a molecule, continues to be widely invoked. There has also been a more recent tendency to view electronegativity as the negative of the chemical potential and to extend it to molecules. However, this leads to results that are incompatible with chemical experience. A more effective approach, which gives results in overall agreement with Pauling's values, is to relate electronegativity to the average valence electron ionization energies of atoms.
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页数:6
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