MICROWAVE SPECTRUM, DIPOLE MOMENT, AND STRUCTURE OF THE HCCH-CO DIMER

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1992

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Ohio State University

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Abstract

Rotational spectra have been observed for several 13C/18O isotopic species of the pseudolinear acetylene-carbon monoxide dimer using the pulsed, Fourier transform Balle/Flygare microwave spectrometer. Our results complement an earlier report by Legon on the dimer.1. A quadrature detection system has been incorporated in the data processing system to avoid folding of the spectrum onto itself in taking the Fourier transform. Dipole moments of 0.3112(12) and 3.29(3) D were determined for the parent species and for HCN-HCCN, respectively. Structural properties were derived from the various measurements, including a well depth of 300cm−1 from Dj, and the results are compared with those reported earlier for HCN-HCCH. A substitution analysis is developed in which the rotational properties of the pseudolinear dimer are treated as a symmetric top2. A simple method is described for determining effects of the off-axis bending of the monomers.

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1 A.C. Legon, A.L. Wallwork, J.W. Bevan, and Z. Wang, Chem. Phys. Lett. 180 , 57 (1991). 2A. Haynes and A.C.Legon, J. Mol. Struct. 189, 153 (1988).


Author Institution: Department of Chemistry, Harvard University; Noyes Chemical Laboratory, University of Illinois

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