Izvestiya of Saratov University.
ISSN 1817-3020 (Print)
ISSN 2542-193X (Online)

phosphororganical compounds

Vibrational Spectra фnd Structural Dinamic Models of Gb-, Gd-, Gf-Agents

An analysis of vibrational spectra of sarine, sorine, cyclosarine (GA-, GB-,GD-, GF-Agents) is carried out by the method DFT/B3LYP in the anharmonic approximation. It is possible to use the second order of anharmonic theory of vibrational spectra for the predictional calculation in phosphororganical compounds.