15min:
THE MICROWAVE SPECTRUM AND MOLECULAR STRUCTURE OF TRIFLUOROETHYLENE-ACETYLENE.

HELEN O. LEUNG, MARK D. MARSHALL, WINN T. CASHION, Department of Chemistry, Amherst College, P.O. Box 5000, Amherst, MA 01002-5000.

The rotational spectra of six isotopomers of the 1,1,2--trifluoroethylene-acetylene complex have been collected in the 6--21 GHz region. In addition to the most abundant isotopomer, spectra are obtained for four isotopomers containing substitution in the HCCH subunit (HCCD, H13C13CH, and H13CCH, which forms two different isotopomers for the complex) and for one isotopomer containing a substitution in the CHFCF2 subunit (CHF13CF2). The spectra of the three isotopomers with a single substitution of 13C are observed in natural abundance upon pulsed jet expansion of a mixture of HCCH, CHFCF2, and Ar. Both a- and b-type transitions are seen, and the deuterium nuclear quadrupole hyperfine structure in HCCD-CHFCF2 is resolved and analyzed. Both the Kraitchman substitution coordinates and the spectroscopic constants are consistent with a planar structure in which a hydrogen bond is formed between H in HCCH and the F on C-2 in CHFCF2 with a secondary interaction between the H (geminal to the F involved in the hydrogen bond) in CHFCF2 and the acetylenic bond.