Structure-property relationship of N-substituted triazolonitroindazoles: A comprehensive study on linear and non-linear optics, as a function of quantum parameters employing density function theory

Moumad, Aziz; Bouhaoui, Abderrazzak; Eddahmi, Mohammed; Hafid, Abderrafia; Dege, Necmi; Asam Raza, Muhammad; Bouissane, Latifa

doi:10.1016/j.comptc.2024.114510

Computational and Theoretical Chemistry

2024

DOI: 10.1016/j.comptc.2024.114510

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Structure-property relationship of N-substituted triazolonitroindazoles: A comprehensive study on linear and non-linear optics, as a function of quantum parameters employing density function theory

Aziz Moumad,

Abderrazzak Bouhaoui,

Mohammed Eddahmi

et al.

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Structure-property relationship of N-substituted triazolonitroindazoles: A comprehensive study on linear and non-linear optics, as a function of quantum parameters employing density function theory

Cited by 3 publications

References 45 publications

Synthesis, structure, spectra, NLO behavior, and in-silico study on anti-tumor and anti-tuberculosis efficacy of (Z)-3-((Z)-3-phenylallylidene)benzo[4,5]imidazo[1,2-c]thiazole-1(3H)-thione

Synthesis, structure, spectra, NLO behavior, and in-silico study on anti-tumor and anti-tuberculosis efficacy of (Z)-3-((Z)-3-phenylallylidene)benzo[4,5]imidazo[1,2-c]thiazole-1(3H)-thione

Synthesis, spectroscopic characterization, and DFT-based solvation studies of static and dynamic Nonlinear Optical activity and Light Harvesting Efficiency of 5-nitro-3-phenyl-7-azaindole

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