Browsing Makale Koleksiyonu by Author "Gunay, N; Tamer, O; Kuzalic, D; Avci, D; Atalay, Y;"

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Synthesis, spectroscopic characterization and DFT calculations on N-(Phenylsulfonyl)-L-asparagine (NPLAS): A potential nonlinear optical material

Nergin Gunay; Tamer, Ömer; Dilek Kuzalic; Avcı, Davut; Atalay, Yusuf (ELSEVIER GMBH, 2016)

The N-(Phenylsulfonyl)-L-asparagine (NPLAS), which is a potential nonlinear optical material, was synthesized and its geometric structure was optimized to obtain its geometric parameters, vibration frequencies and electronic ...
Theoretical Investigation of N-Methyl-N '-(4-nitrobenzylidene) pyrazine-2-carbohydrazide: Conformational Study, NBO Analysis, Molecular Structure and NMR Spectra

N. Gunay; Tamer, Ömer; D. Kuzalic; Avcı, Davut; Atalay, Yusuf (POLISH ACAD SCIENCES INST PHYSICS, 2015)

The crystal structure determination of the methylated pyrazine-2-carbohydrazide derivative, namely N-methyl-N'-(4-nitrobenzylidene)pyrazine-2-carbohydrazide were optimized to obtain its molecular geometric structure and ...