VIBRATIONAL SPECTRA AND ASSIGNMENT FOR 3,3,4,4-TETRAFLUOROCYCLOBUTENE-$D_{0}$-$D_{1}$, AND $-D_{2}$

Loading...
Thumbnail Image

Date

1992

Journal Title

Journal ISSN

Volume Title

Publisher

Ohio State University

Research Projects

Organizational Units

Journal Issue

Abstract

The three hydrogen-deuterium isotopomers of tetrafluorocyclobutene are near-prolate symmetric tops. The two C2v species are unusual in having their dipole axes perpendicular to the pseudo-figure axis, Ia. In addition, the Ia axis is parallel to the dipole axis in the d0 species but perpendicular to it in the d2 species. 1 Under these circumstances B-type and C-type band shapes are essentially indistinguishable in gas-phase infrared spectra. Nonetheless, a reasonably complete and convincing assignment of vibrational fundamentals can be made from the infrared and Raman spectra of the three isotopomers, considered together. For the d0 species selection rules and fundamentals (in cm−1) are (a1; IR, C-type; R, pol) 3154, 1564, 1350, 1155, 1025, 755, 500, 277; (a2; IR, -; R, dp) --, 966, 348, --, 132; (b1 IR, A-type; R, dp) 3108, 1338, 1177, 1058, 730, 614, 431; (b2 IR, B-type; R, dp) 1340, 799, 366, 208.

Description

  1. A. E. Andrews, S. L. Maruca, K. W. Hillig II, R. L. Kuczkowski, and N. C. Craig, J. Phys. Chem. 95, 7714 (1991).

Author Institution: Department of Chemistry, Oberlin College

Keywords

Citation