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Structure and IR Spectra of 3(5)-Aminopyrazoles and UV-Induced Tautomerization in Argon Matrix

The prototropic tautomerism in 3(5)-aminopyrazoles was investigated by matrix isolation infrared (IR) spectroscopy, supported by DFT(B3LYP)/6-311++G(d,p) calculations. In consonance with the experimental data, the calculations predict tautomer 3-aminopyrazole (3AP) to be more stable than the 5-amino...

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Detalles Bibliográficos
Autores principales: Secrieru, Alina, Lopes, Susy, Cristiano, Maria L. S., Fausto, Rui
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8304260/
https://www.ncbi.nlm.nih.gov/pubmed/34299574
http://dx.doi.org/10.3390/molecules26144299