| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 444805 | Journal of Molecular Graphics and Modelling | 2006 | 4 Pages |
Abstract
The results of the calculation of several molecular descriptors of isomeric thiadiazoles through the CBS-QB3 model chemistry are presented in this work. The results could be useful in quantitative structure–activity relationship (QSAR) or quantitative structure–property relationship (QSPR) studies of derivatives of the nitrogen-containing analogs of thiophene.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Daniel Glossman-Mitnik,