Synthesis, spectroscopic and structural characterization of two (2,4,6-tribromophenyl)thiourea
N. Burcu Arslan,
Fatma Aydın
Abstract:Two new compounds N-Benzoyl-N'-tribromophenyl thiourea (C14H9Br3N2OS) (I) and 4-Nitrobenzoyl-N'-tribromophenyl thiourea (C14H8Br3N3O3S) (II) were synthesized and characterized by 1HNMR, 13CNMR, IR, and structural (XRD) techniques. The molecular geometry, vibrational frequencies of the title compound (I, II) in the ground state have been calculated by using the density functional theory (DFT) method with B3LYP / 6–311G(d,p) basis set and compared with the experimental data. The calculated results show that the … Show more
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