THE MICROWAVE-SPECTRUM OF N-BUTYRALDEHYDE OXIME

Citation
N. Kuze et al., THE MICROWAVE-SPECTRUM OF N-BUTYRALDEHYDE OXIME, Journal of molecular spectroscopy (Print), 191(1), 1998, pp. 1-8
Citations number
13
Categorie Soggetti
Spectroscopy,"Physics, Atomic, Molecular & Chemical
ISSN journal
00222852
Volume
191
Issue
1
Year of publication
1998
Pages
1 - 8
Database
ISI
SICI code
0022-2852(1998)191:1<1:TMONO>2.0.ZU;2-W
Abstract
The microwave spectrum of n-butyraldehyde oxime was observed in the fr equency region 26.5-40 GHz. Four rotational conformers were found to e xist in the gas phase; among these, two conformers belonged to the (E) -geometrical isomer and the other two to the (Z)-geometrical isomer. T he microwave spectrum attributed to one of these two rotational confor mers of (E)-butyraldehyde oxime was analyzed, and its rotational const ants for the ground vibrational state were determined: A = 15883(379), B = 1269.97(1), C = 1251.60(1) MHz. The conformational structure of t he molecule is discussed, referring to the rotational constants obtain ed and the ab initio molecular orbital calculation. (C) 1998 Academic Press.