Article ID Journal Published Year Pages File Type
7843598 Journal of Molecular Liquids 2018 34 Pages PDF
Abstract
The best orbital cut-off for predicting aqueous solubility using Cramer et al. solubility equation shows an inverse linear relationship with molecular weights of the dyes (A) contrary to the best cut-off for the general solubility equation (B).239
Keywords
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
DMol3/COSMO-RS prediction of aqueous solubility and reactivity of selected Azo dyes: Effect of global orbital cut-off and COSMO segment variation
Authors
, , , ,