15min:
SUBMILLIMETER WAVE SPECTRA OF NCS.

A. MAEDA, H. HABARA, T. AMANO, Institute for Astrophysics and Planetary Sciences, Ibaraki University, 2-1-1 Bunkyo, Mito 310-8512, Japan.

Rotational spectra of NCS in the excited bending vibrational states have not been analyzed in detail, because of difficulty in analysis due to large Renner - Teller effect and anharmonic interactions. We have extended the observation of the pure rotational spectra of NCS in the v2 = 1 as well as in the X2 Pi ground state up to J = 53.5 in the submillimeter wave region. For the ground state, the analysis was straightforward. The measured transition frequencies were fit to a standard effective Hamiltonian for 2 Pi vibronic states, and the improved molecular constants including the higher order centrifugal distortion constants were obtained. The v2 = 1 vibronic state splits into four vibronic sub-states, 2 Delta 5/2, 2 Delta 3/2, µ 2 Sigma and kappa 2 Sigma. As a first attempt, the Delta and Sigma states were fitted separately to effective Hamiltonians. The least square fittings converged by including various effective parameters concerned with the P-type doubling. However, the physical significance of these higher order parameters is not clear. It is found that the spin rotation coupling constant, gamma, and the Lambda-type doubling constants, p, q, are significantly different from those for the ground state. We have attempted to analyze the Delta and Sigma states simultaneously by taking into account the perturbations from higher vibrational states.

An isotopic species, NC34S, in the X 2 Pi 3/2 state has also been measured and r0 structure is derived to be r0(NC)= 1.1805 (1) Å and r0(CS)= 1.63212 (7) Å.