Theorecital examination of spectroscopic properties of styrylkinoline- chalcone hybrid compounds

In our age, allure has emerged as the most important factor in the consumption of materials and materials. Albeni is the basis of image-based consumption. The most important place in the material and material appeal is the color of materials and materials. Today, azo dyestuffs are used most commonly in the production of colored materials and materials. Dyestuffs are widely used in the coloring of all materials and materials offered for consumption. Azo dyes are widely used in inkjet printers, electro-optical devices, simulation studies, metalochromic indicators, photochromic materials, photo-sensitizers, biological medical studies, lasers, sensors, dye-sensitive solar cells, liquid crystal displays [7]. These compounds are widely used in pharmacological and medical terms with their antifungal, antibacterial, antitumor and antioxidant properties [7]. The fact that these compounds have tautomers may explain their good photo-physical and photo-chemical properties. He also contributed to the literature along with experimental studies in the theoretical calculations using Density Functional Theory (DFT) and the ab-initio simulation technique based on the Hartee-Fock (HF) method. [8-9-10]. Recently, Sener and colleagues synthesized disazo dye containing pyrazole structure (skeleton) and characterized the structure with FT-IR, 1H-NMR and 13C_NMR [11]. Yildirim et al. Synthesized a new series of sandarins based on disazo dye and their spectroscopic properties were investigated experimentally and theoretically by Yıldırım et al. [12] In this thesis, with the DFT theory calculations of monoazo dyes which will be newly synthesized; It is planned to obtain spectroscopic properties of the compounds to be synthesized such as structural, vibration and chemical shifts. New Mono-Azo dyestuff compounds Some spectrum analyzes to be synthesized in PAU-FEF Chemistry Department laboratories will be carried out. At the same time, the spectroscopic calculations of the compounds to be synthesized will be carried out in the Physics and Material Physics and Simulation Laboratory of the Department of Physics by using quantum calculation methods.