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Title: The molecular structure and a Renner-Teller analysis of the ground and first excited electronic states of the jet-cooled CS2 + molecular ion. Author: He SG, Clouthier DJ. Journal: J Chem Phys; 2006 Feb 28; 124(8):084312. PubMed ID: 16512721. Abstract: The A 2Pi(u) - X 2Pi(g) electronic band system of the jet-cooled CS2 + ion has been studied by laser-induced fluorescence and wavelength-resolved emission techniques. The ions were produced in a pulsed electric discharge jet using a precursor mixture of carbon disulfide vapor in high-pressure argon. Rotational analysis of the high-resolution spectrum of the 2Pi32 component of the 0(0) 0 band gave linear-molecule molecular structures of r0" = 1.5554(10) A and r0' = 1.6172(12) A. Renner-Teller analyses of the vibronic structure in the spectra showed that the ground-state spin-orbit splitting (A = -447.0 cm(-1)) is much larger than that of the excited state (A = -177.5 cm(-1)), but that the Renner-Teller parameters are of similar magnitude and that a strong nu1 - 2nu2 Fermi resonance occurs in both states. Previous analyses of the vibronic structure in the ground and excited states of the ion from pulsed field-ionization-photoelectron data are shown to be substantially correct.[Abstract] [Full Text] [Related] [New Search]