Gene/Protein Disease Symptom Drug Enzyme Compound
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This work reports a temperature-dependent vibrational spectroscopic study of the sorbic acid (C6H8O2), as well as the mode assignment at ambient conditions, based on the density functional theory. Temperature-dependent vibrational properties have been performed in polycrystalline sorbic acid through both Raman and infrared spectroscopy in the 20-300 K and 80-300 K temperature ranges, respectively. These studies present the occurrence of some modifications in the Raman spectra that could be interpreted as a low temperature phase transition undergone by sorbic acid from the monoclinic phase to an unknown phase with conformational change of the molecules in the unit cell.
Spectrochim Acta A Mol Biomol Spectrosc 2015 Feb 25
PMID:Temperature-dependent vibrational spectroscopic study and DFT calculations of the sorbic acid. 2531 Feb 62