Artículo

Infrared matrix-isolation studies of the CS2···HCl molecular complex

Picone, Andrea LorenaIcon ; Romano, Rosana MarielIcon
Fecha de publicación: 01/2010
Editorial: Elsevier Science
Revista: Journal of Molecular Structure
ISSN: 0022-2860
Idioma: Inglés
Tipo de recurso: Artículo publicado
Clasificación temática:

Resumen

Matrix isolation infrared spectroscopy has been combined with density functional theory calculations to characterize the molecular complex formed between CS2 and HCl. Besides the shifts on the vibrational modes of the CS2 and HCl subunits, the activation of the symmetrical stretching of the CS2 moiety was also observed in the matrix spectra. Additionally, an intermolecular vibrational mode of S@C@SHCl was detected near 230 cm1 . The bonding properties of the complex have been interpreted by natural bond orbital (NBO) analysis in terms of ‘‘donor–acceptor” interactions.
Palabras clave: MATRIX-ISOLATION , FTIR , MOLECULAR COMPLEXES
 
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info:eu-repo/semantics/restrictedAccess Excepto donde se diga explícitamente, este item se publica bajo la siguiente descripción: Creative Commons Attribution-NonCommercial-ShareAlike 2.5 Unported (CC BY-NC-SA 2.5)
Identificadores
URI: http://hdl.handle.net/11336/276698
Colecciones
Articulos(CEQUINOR)
Articulos de CENTRO DE QUIMICA INORGANICA "DR. PEDRO J. AYMONINO"
Citación
Picone, Andrea Lorena; Romano, Rosana Mariel; Infrared matrix-isolation studies of the CS2···HCl molecular complex; Elsevier Science; Journal of Molecular Structure; 978; 1-2010; 187-190
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