Theoretical prediction of the Abraham hydrogen bond acidity and basicity factors from a reaction field method.

Cacelli, Ivo

Theoretical prediction of the Abraham hydrogen bond acidity and basicity factors from a reaction field method. [electronic resource] - Journal of chemical information and modeling - 327-33 p. digital

Publication Type: Journal Article; Research Support, Non-U.S. Gov't

1549-9596

10.1021/ci049688f doi


Acids--chemistry
Alkalies--chemistry
Computers
Hydrogen Bonding
Hydrogen-Ion Concentration
Models, Chemical