15min:
ROTATIONAL SPECTRA OF HALOGENATED ETHERS USED AS VOLATILE ANAESTHETICS.

ALICIA VEGA-TORIBIO AND ALBERTO LESARRI, Departamento de Química Física y Química Inorgánica, Facultad de Ciencias, Universidad de Valladolid, E-47011 Valladolid, Spain; RICHARD D. SUENRAM, Department of Chemistry, University of Virginia, Charlottesville, VA 22904, USA; JENS-UWE GRABOW, Institut für Physikalische Chemie und Elektrochemie, Leibniz Universität Hannover, Callinstraß e 3 - 3A, D-30167 Hannover, Germany.

Following previous microwave investigations by Suenram et al. \footnoteR.~D.~Suenram, D.~J.~Brugh, F.~J.~Lovas and C.~Chu, 51^st ~OSU~Int.~Symp.~On~Mol.~Spectrosc., Columbus, OH, 1999, RB07 we will report on the rotational spectrum of several halogenated ethers used as volatile anaesthetics, including sevoflurane ((CF3)2CH-O-CH2F), isoflurane (CF3CHCl-O-CHF2), enflurane (CHFClCF2-O-CHF2) and methoxyflurane (CHCl2CF2-O-CH3). This study has been conducted in the 6-18 GHz centimetre-wave region using Balle-Flygare-type FT-microwave spectroscopy. The results will include the analysis of the rotational spectra of minor species in natural abundance (13C and 18O in some cases), structural calculations and auxiliary ab initio modelling. The conformational and structural conclusions will be compared with previous gas-phase electron diffraction and solid-state X-ray diffraction analysis.