DFT Quantum Chemical Studies on Structural, Nonlinear Optical, Reactivity and Thermodynamic Properties of 4‐Methoxy‐2‐{(E)‐[(thiophen‐2‐yl) ethylimino] methyl} …

H Tanak - ChemistrySelect, 2019 - Wiley Online Library
The molecular structure of 4‐Methoxy‐2‐{(E)‐[(thiophen‐2‐yl) methylimino] methyl} phenol
was optimized using the PBEPBE, B3PW91 and B3LYP methods with the 6–311++ G (d, p) …

Molecular structure, spectroscopic and density functional studies on 2-{[(5-nitrothiophen-2-yl) methylidene] amino} phenol

H Tanak, L Semiz, F Koçak, AA Ağar, N Özdemir - Optik, 2019 - Elsevier
Abstract The characterization of 2-{[(5-nitrothiophen-2-yl) methylidene] amino} phenol Schiff
base was performed by FTIR and UV–vis spectroscopic techniques. Theoretical …

Crystal Structure, Spectroscopic and DFT Computational Studies of N-(4-Fluorophenyl)-1-(5-Nitrothiophen-2-yl)methanimine

H Tanak, Ş Karataş, S Meral, AA Ağar - Crystallography Reports, 2020 - Springer
A novel Schiff base compound was synthesized and characterized by IR spectroscopy and X-
ray diffraction method. The compound crystallizes in monoclinic space group P 21/c with Z …