Autor:	C. Sigüenza, Pedro F. González-Díaz
Rok vydání:	1985
Předmět:	Infrared Chemistry Organic Chemistry Solid-state Infrared spectroscopy Analytical Chemistry Inorganic Chemistry CNDO/2 chemistry.chemical_compound Tilt (optics) Organic chemistry Physical chemistry Phenol Phenols Physics::Chemical Physics Spectroscopy
Zdroj:	Journal of Molecular Structure. 131:89-100
ISSN:	0022-2860
DOI:	10.1016/0022-2860(85)85103-6
Popis:	The IR spectra of some halogenated symmetric derivatives of phenol in solid state are reported. The CNDO/2 method has been applied to calculate the V 2 torsional barrier; this method gives larger values than those obtained from other conventional methods. The origin of the tilt angle in phenols is discussed.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::a7b1d779e7dec403e74701d9d557569d https://doi.org/10.1016/0022-2860(85)85103-6 Zobrazit plný text záznamu