New Insights on the Vibrational Dynamics of 2-Methoxy-, 4-Methoxy- and 4-Ethoxy-Benzaldehyde from INS Spectra and Periodic DFT Calculations

The dynamics of 2-methoxybenzaldehyde, 4-methoxybenzaldehyde, and 4-ethoxybenzaldehyde in the solid state are assessed through INS spectroscopy combined with periodic DFT calculations. In the absence of experimental data for 4-ethoxybenzaldehyde, a tentative crystal structure, based on its similarit...

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Detalles Bibliográficos
Autores principales: Ribeiro-Claro, Paulo J. A., Vaz, Pedro D., Nolasco, Mariela M., Gil, Francisco P. S. C., de Carvalho, Luís A. E. Batista, Marques, Maria Paula M., Amado, Ana M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8399430/
https://www.ncbi.nlm.nih.gov/pubmed/34443083
http://dx.doi.org/10.3390/ma14164561

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8399430/
https://www.ncbi.nlm.nih.gov/pubmed/34443083
http://dx.doi.org/10.3390/ma14164561

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