RELATIONSHIPS BETWEEN SOLUTE HYDROGEN-BOND ACIDITY BASICITY AND THE CALCULATED ELECTROSTATIC POTENTIAL

被引:0
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作者
MURRAY, JS [1 ]
POLITZER, P [1 ]
机构
[1] UNIV NEW ORLEANS,DEPT CHEM,NEW ORLEANS,LA 70148
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O6 [化学];
学科分类号
0703 ;
摘要
For several families of molecules, we have demonstrated that good relationships exist between (a) electrostatic potential minima and the solute hydrogen-bond-basicity parameters beta(2)H, and (b) the surface electrostatic potential maxima and the solute hydrogen-bond-acidity parameters alpha(2)H.
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页码:110 / 111
页数:2
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