Effect of specific solvation on the electronic and geometric structure of thiourea dioxide

Authors
Makarov, SV Kudrik, EV Lyubimtsev, AV Stulov, DM
Citation
Sv. Makarov et al., Effect of specific solvation on the electronic and geometric structure of thiourea dioxide, RUSS J G CH, 70(9), 2000, pp. 1395-1398
Citations number
8
Categorie Soggetti
Chemistry
Journal title
RUSSIAN JOURNAL OF GENERAL CHEMISTRY
ISSN journal
10703632 → ACNP
Volume
70
Issue
9
Year of publication
2000
Pages
1395 - 1398
Database
ISI
SICI code
1070-3632(200009)70:9<1395:EOSSOT>2.0.ZU;2-K
Abstract
The AM1 method was used to study the electronic and geometric structure of thiourea dioxide. In the reacting molecule approximation, the structure and reactivity of thiourea dioxide were shown to be much solvent-dependent.