We have recorded the room temperature CH stretching overtone spectra of pyridine, both in the vapor and in the liquid phase. We have used intracavity laser photoacoustic as well as conventional near-infrared absorption spectroscopy to measure these overtone transitions. Peaks corresponding to three nonequivalent CH stretching local modes are assigned in the high-energy vapor phase spectrum, as opposed to previous investigations which assigned only two. Absolute oscillator strengths are obtained from the conventional spectra and relative oscillator strengths between the observed peaks within a given overtone from the photoacoustic spectra. Oscillator strengths are calculated with an anharmonic oscillator local mode model and ab initio dipole moment functions. In the high-energy vapor phase spectrum, we have assigned the three peaks based on comparisons with ab initio calculated bond lengths and accurate overtone intensity calculations. Our simple calculations, which contain no adjustable parameters, are in very good agreement with both the absolute and relative observed intensities.
scite is a Brooklyn-based organization that helps researchers better discover and understand research articles through Smart Citations–citations that display the context of the citation and describe whether the article provides supporting or contrasting evidence. scite is used by students and researchers from around the world and is funded in part by the National Science Foundation and the National Institute on Drug Abuse of the National Institutes of Health.
hi@scite.ai
10624 S. Eastern Ave., Ste. A-614
Henderson, NV 89052, USA
Copyright © 2024 scite LLC. All rights reserved.
Made with 💙 for researchers
Part of the Research Solutions Family.