Synthesis and structural properties of $N$-3,4-(dichlorophenyl)-3-oxo-3- phenyl-2-(phenylcarbonyl)propanamide and its Cu(II) complex

Authors : Ahmet Oral SARIOĞLU, Tuğba Taşkin TOK, Mehmet AKKURT, Muhammad Nawaz TAHIR, Mehmet SÖNMEZ

Pages : 76-92

View : 12 | Download : 4

Publication Date : 0000-00-00

Article Type : Research Paper

Abstract :A new N-carboxamide compound insert ignore into journalissuearticles values(3); was synthesized by the reaction of dibenzoylaceticacid-$N$-carboxyethyla\-mide insert ignore into journalissuearticles values(1); and 3,4-dichloroaniline insert ignore into journalissuearticles values(2);. The $N$-insert ignore into journalissuearticles values(3,4-dichlorophenyl);-3-oxo-3-phenyl-2-insert ignore into journalissuearticles values(phenylcarbonyl); propanamide insert ignore into journalissuearticles values(3); subsequently reacted with Cu salt to produce its Cuinsert ignore into journalissuearticles values(II); complex compound insert ignore into journalissuearticles values(4);. The compounds were characterized by analytical and spectral methods. In addition, X-ray diffraction was performed to characterize and obtain detailed information about the structure of 3. The fully optimized geometries of compounds 3 and 4 were calculated at different basis sets by using the Gaussian09 insert ignore into journalissuearticles values(G09); software to investigate their 3D geometries and electronic structures. Comparisons between the calculated and experimental data including molecular structures, fundamental vibrational modes, and electronic properties were made. The comparisons showed that the theoretical data were compatible with the corresponding experimental values of compounds 3 and 4.
Keywords : Carboxamide, copper complex, X ray, computational analysis