Structural and energetic properties of the Br--C2H2 anion complex from rotationally resolved mid-infrared spectra and ab initio calculations

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Abstract

The properties of the proton bound Br--C2H2 complex revealed through mid-infrared vibrational predissociation spectroscopy and ab initio calculations were studied. It was found that the mid-infrared vibrational predissociation spectrum of the studied complex is consistent with a linear, proton-bound complex. Rotationally resolved features were observed in the v3 band that have an onset at a specific J′ value.

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Wild, D. A., Milley, P. J., Loh, Z. M., Wolynec, P. P., Weiser, P. S., & Bieske, E. J. (2000). Structural and energetic properties of the Br--C2H2 anion complex from rotationally resolved mid-infrared spectra and ab initio calculations. Journal of Chemical Physics, 113(3), 1075–1080. https://doi.org/10.1063/1.481919

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