6-Substituted benzothiazole based dispersed azo dyes having pyrazole moiety: Synthesis, characterization, electrochemical and DFT studies

被引:69
作者
Maliyappa, M. R. [1 ]
Keshavayya, J. [1 ]
Mahanthappa, Mallappa [2 ,3 ]
Shivaraj, Y. [2 ]
Basavarajappa, K., V [1 ]
机构
[1] Kuvempu Univ, Dept PG Studies & Res Chem, Shivamogga 577451, Karnataka, India
[2] Govt Sci Coll, Dept Chem, Bengaluru 560001, Karnataka, India
[3] REVA Univ, Sch Appl Sci, Dept Chem, Bengaluru 560001, Karnataka, India
关键词
Benzothiazole; Azo dyes; DFT; Cyclic voltammetry; SPECTRAL CHARACTERIZATION; CRYSTAL-STRUCTURES; LIQUID-CRYSTAL; VOLTAMMETRY; BEHAVIOR; SERIES;
D O I
10.1016/j.molstruc.2019.126959
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
In the present work discusses synthesis, structural characterization and electrochemical investigation on some azo dyes derived from substituted benzothiazoles. The conventional diazo-coupling method was adopted to afford the heterocyclic azo dyes of benzothiazoles having pyrazole moiety. The obtained azo dyes were characterized by FT-IR, UV-visible, fluorescence, (HNMR)-H-1 and, mass spectrometric techniques. The quantum chemical studies (DFT) was also used to interpret the structural properties of the compounds by using B3LYP program at 6-311++ (d, p) basis set. Further, the cyclic voltammetry was used to study the electrochemical behavior of the synthesized azo dyes in 0.1 M H2SO4 solution on a glassy carbon electrode at different scan rates. (C) 2019 Elsevier B.V. All rights reserved.
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页数:11
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