Vibrational Spectroscopies, Global Reactivity, Molecular Docking, Thermodynamic Properties and Linear and Nonlinear Optical Parameters of Monohydrate Arsenate Salt of 4-Aminopyridine

In this work, a structural and electronic properties of a novel organic arsenate template by 4-aminopyridine, with the general formula (C(5)H(7)N(2))(C(5)H(8)N(2))[AsO(4)]·H(2)O ((4-APH)(4-APH(2))[AsO(4)]·H(2)O) have been presented. The density functional theory (DFT) along with B3LYP hybrid functio...

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Detalles Bibliográficos
Autores principales: Mhadhbi, Noureddine, Dgachi, Souad, Ben Ahmed, Ali, Issaoui, Noureddine, Nasr, Samia, Badraoui, Riadh, Badraoui, Bechir, Naïli, Houcine
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2023
Materias:
Original Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9926452/
http://dx.doi.org/10.1007/s42250-023-00620-8

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