The Microwave Spectrum of trans-2,3-Dimethyloxirane in Torsional Excited States

H. Hartwig 1  and H. Dreizler 1
  • 1 Institut für Physikalische Chemie, Christian-Albrechts-Universität zu Kiel, Olshausenstr. 40. D-24098 Kiel

Abstract

The microwave spectrum of trans-2,3-dimethyloxirane (CH3CHOCHCH3) in the excited tor-sional states υ17 = 1 and υ33 = 1 has been measured in the range from 8 to 26 GHz and assigned. An analysis of internal rotation splittings of the observed rotational transitions was performed using the internal axis method (or "combined axis method") with a newly developed program accounting for the top-top coupling. The threefold hindering potential V3 and the direction cosines λ g,i of the internal rotation axes i with respect to the principal inertia axes g are in a good agreement with the ground state values. Additionally, the sixfold hindering parameter V6 was found to be - 0.2600(12) kJ/mol. The value of the parameter V′12 describing the top-top coupling in the potential function (via V′12 sin 3 τ1 sin 3 τ2), was determined to -0.4240(6) kJ/mol.

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A Journal of Physical Sciences: Zeitschrift für Naturforschung A (ZNA) is an international scientific journal which publishes original research papers from all areas of experimental and theoretical physics. In accordance with the name of the journal, which means “Journal for Natural Sciences”, manuscripts submitted to ZNA should have a tangible connection to actual physical phenomena.

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