Nesrin ŞENER, Mahmut GÜR2023-05-092023-05-092018-06-01Şener, N., Gür, M. (2018). Novel 1,3,4-thiadiazole compounds derived from 4-phenylbutyric acid: Synthesis, characterization and DFT studies. Balıkesir Üniversitesi Fen Bilimleri Enstitüsü Dergisi, 20(1), 145-155https://search.trdizin.gov.tr/publication/detail/316051/novel-134-thiadiazole-compounds-derived-from-4-phenylbutyric-acid-synthesis-characterization-and-dft-studieshttps://hdl.handle.net/20.500.12597/7762https://hdl.handle.net/20.500.12597/14530In this study; new 1,3,4-thiadiazole compounds were synthesized and their structural characterization were carried out by using FT-IR, 1H-NMR, 13C-NMR spectroscopic methods, and elemental analysis. Furthermore, the absorption properties of the synthesized compounds were also studied with UV-Vis. spectrophotometer. In addition, molecular conformation, electronic properties and UV-vis analysis of synthesized 1,3,4-thiadiazole compounds were theoretically investigated by using density functional theory (DFT), and how F, Cl and methoxy isomers affected the molecular configuration was analyzed.info:eu-repo/semantics/openAccessRESEARCH10.25092/baunfbed.343149316051145155