Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
9591199 | Journal of Molecular Structure: THEOCHEM | 2005 | 4 Pages |
Abstract
The results of the calculation of the molecular structure and of several molecular descriptors of isomeric thiadiazoles through the G3-B3 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,