Author/Authors
BERBER, Halil Anadolu Üniversitesi - Fen Fakültesi - Kimya Bölümü, Turkey , UYSAL, Ülkü Dilek Anadolu Üniversitesi - Fen Fakültesi - Kimya Bölümü, Turkey
Title Of Article
THEORETICAL INVESTIGATION OF SYNTHESIS OF CERTAIN DIIMMINE SCHIFF BASES, GEOMETRIES AND STABILITY OF TAUTOMER STRUCTURES BY DFT
شماره ركورد
41869
Abstract
In this study, theoretical calculations of certain diimine Schiff bases synthesized by us were fulfilled using Gaussian package program with DFT (Density Functional Theory). Stable tautomer structures, possible geometries and stability of synthesis steps of the studied molecules were calculated theoretically. The calculated data were compared with those experimental ones.
From Page
105
NaturalLanguageKeyword
Formazan , Tautomerism , Theoretical calculation , DFT.
JournalTitle
Eskişehir Technical University Journal of Science and Technology B - Theoretical Sciences
To Page
126
JournalTitle
Eskişehir Technical University Journal of Science and Technology B - Theoretical Sciences
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