Synthesis, photophysical properties, and in-silico nonlinear optics of 3-hydroxy-N-phenyl-2-naphthamide and its acetate, acrylate, and benzoate derivative

ZA Siddiqui, U Singh, S More, N Sekar - Journal of Molecular Structure, 2025 - Elsevier
In this study, we report the successful growth of single crystals of 3-hydroxynaphthalene-2-
carboxanilides (NAS) with a monoclinic structure in the P21/c space group and space group …

Influence of substituent at the para position of tetraphenylethylene on static and dynamic nonlinear optical properties: In-silico approach

ZA Siddiqui, S More, N Sekar - Computational and Theoretical Chemistry, 2024 - Elsevier
In this study, tetraphenylethylene (TPE) derivatives with various substituents (F, OH, OMe,
CN, NO 2, and NO) at the para position were selected for the non-linear optical properties …

Structural, electronic, and NLO properties of two acridone alkaloîds: DFT and TD-DFT studies

V de Paul Zoua, AF Atangana, AQ Asi… - Journal of Molecular …, 2024 - Springer
Context The structural, electronic, and nonlinear optical properties of Verdoocridone A (Ver
A) and B (Ver B) are examined theoretically in this study. The results showed that Ver A and …