THEORETICAL CALCULATIONS OF SOME PHYSICAL VARIABLES AFFECTING SCHIFF'S RULES USING QUANTUM MECHANICS METHODS (AM1, HF)

Abstract

This study included the calculation and estimation of the ionization constant for a number of Schiff base compounds using different theoretical arithmetic methods by using Gaussian 09 and Chem Office12.0 and also using SPSS statistics by multi-relationship regression analysis between the values of constants Practical ionization of compounds with theoretically calculated physical variables where calculations were made using quantum mechanics methods.