Abstract
We fitted published frequency and wave number data for pure rotational and vibration-rotational spectra, respectively, of 23Na35Cl and 23Na37Cl to derive parameters related to potential energy and to the rotational g factor. For comparison with these experimental data we undertook quantum-chemical computation of adiabatic corrections, rotational and vibrational g factors, electric dipolar moment and its derivative as a function of internuclear distance in a range near Re as a test of an algebraic approach to spectral analysis; experimental, 0.0287 ± 0.0014, and calculated, 0.02149, values of gr at Re are in moderate agreement. The combined results are discussed from a point of view of computational spectrometry.
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