화학공학소재연구정보센터
검색결과 : 3건
No. Article
1 Intramolecular hydrogen-bonding interactions in 2-nitrosophenol and nitrosonaphthols: Ab initio, density functional, and nuclear magnetic resonance theoretical study
Shchavlev AE, Pankratov AN, Enchev V
Journal of Physical Chemistry A, 111(30), 7112, 2007
2 Theoretical studies on the intramolecular hydrogen bond and tautomerism of 8-mercaptoquinoline in the gaseous phase and in solution using modern DFT methods
Shchavlev AE, Pankratov AN, Shalabay AV
Journal of Physical Chemistry A, 109(18), 4137, 2005
3 DFT study of the monomers and dimers of 2-pyrrolidone: Equilibrium structures, vibrational, orbital, topological, and NBO analysis of hydrogen-bonded interactions
Shchavlev AE, Pankratov AN, Borodulin VB, Chaplygina OA
Journal of Physical Chemistry A, 109(48), 10982, 2005