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Large Amplitude Motions of Pyruvic Acid (CH(3)-CO-COOH)

Torsional and rotational spectroscopic properties of pyruvic acid are determined using highly correlated ab initio methods and combining two different theoretical approaches: Second order perturbation theory and a variational procedure in three-dimensions. Four equilibrium geometries of pyruvic acid...

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Detalles Bibliográficos
Autores principales:	Senent, María Luisa, Dalbouha, Samira
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2021
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8303138/ https://www.ncbi.nlm.nih.gov/pubmed/34299546 http://dx.doi.org/10.3390/molecules26144269

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