Experimental and theoretical spectroscopic (FT-IR, FT-Raman, UV-VIS) analysis, natural bonding orbitals and molecular docking studies on 2-bromo-6-methoxynaphthalene: A potential anti-cancer drug

The vibrational, electronic and charge transfer studies on 2-bromo-6-methoxynaphthalene (2BMN) were done using DFT method with B3LYP/6-311++G(d,p) theory using GAUSSIAN 09W software. Theoretical and experimental investigations on FT-IR and FT Raman were executed on 2BMN. The calculated vibrational w...

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Detalles Bibliográficos
Autores principales: Saji, Rinnu Sara, Prasana, Johanan Christian, Muthu, S., George, Jacob
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2021
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8209084/
https://www.ncbi.nlm.nih.gov/pubmed/34169166
http://dx.doi.org/10.1016/j.heliyon.2021.e07213

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8209084/
https://www.ncbi.nlm.nih.gov/pubmed/34169166
http://dx.doi.org/10.1016/j.heliyon.2021.e07213

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