A combined experimental and theoretical study of the tautomeric and conformational properties of (5-phenyl-tetrazol-2-yl)-acetic acid methyl ester

The tautomeric and conformational properties of a new tetrazole derivative are studied in a combined approach that includes the analysis of the experimental vibrational data together with theoretical calculation methods, especially in terms of natural bond orbital (NBO) population analysis. Moreover...

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Detalles Bibliográficos
Autores principales:	Saeed, Aamer, Qasim, Muhammad, Hussain, Majid, Flörke, Ulrich, Erben, Mauricio Federico
Formato:	Articulo
Lenguaje:	Inglés
Publicado:	2015
Materias:	Química Tetrazole Vibrational spectroscopy Quantum chemical calculations Crystal structure Conformational analysis Tautomerism
Acceso en línea:	http://sedici.unlp.edu.ar/handle/10915/107627
Aporte de:	SEDICI (UNLP) de Universidad Nacional de La Plata

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