Turkish Journal of Chemistry
Abstract
The retention times are studied for two sets of 1-bromo-2-aryiloxyetanes and 3- aryloxypropiononitriles derivatives by means of Quantitative Structure-Retention Relationships (QSRR}). Five quantum mechanical molecular descriptors are used to calculate the regression equations. The fitting polynomials are computed in several-variable at first, second, and third order equations. Results are only significant when resorting to several-variable formulae which seems to point out the rather complex physical chemistry nature of the property under study.
DOI
-
Keywords
QSRR - Quantum mechanical molecular descriptors - Retention Index - Bromo and Nitrile Derivatives
First Page
335
Last Page
344
Recommended Citation
ROMANELLI, G. P, AUTINO, J. C, & CASTRO, E. A (2002). Application of Quantitative Structure-Retention Relationships (QSRR) to a Set of Organic Bromo and Nitrile Derivatives. Turkish Journal of Chemistry 26 (3): 335-344. https://doi.org/-
