|
|||||
|
|
A quantum chemical based toxicity study of estimated reduction potential and hydrophobicity in series of nitroaromatic compounds |
|
| Authors: | A Gooch N Sizochenko L Sviatenko L Gorb |
| Institution: | 1. Interdisciplinary Center for Nanotoxicity, Jackson State University, Jackson, USA;2. Department of Organic Chemistry, Oles Honchar Dnipropetrovsk National University, Dnipropetrovsk, Ukraine;3. HX5, Vicksburg, USA |
| Abstract: | |
| Keywords: | QSAR nitroaromatic toxicity reduction potential hydrophobicity LUMO energy |