Jet-cooled spectroscopy of paracetamol

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Abstract

We have measured the resonant 2-photon ionization spectrum of jet-cooled p-acetaminophenol (paracetamol) between 33400 cm-1 and 45500 cm -1, and analysed the results in the light of theoretical calculations of the ground-state geometry and vibrational frequencies. The experimental spectrum consists of a large number of clearly resolved vibronic transitions, and some evidence of rotational structure. It is dominated by a repeated progression with a regular spacing of 33 cm-1 (believed to be the methyl-torsion mode) in combination with normal modes of vibration which involve the stretching of the C-C bonds in the phenyl ring and bending of the C-N-C bond in the amide group. The intensity pattern of the progressions in the methyl torsion is consistent with structural changes between the minimum-energy geometries in the ground and excited states.

Original languageEnglish
Pages (from-to)4157-4164
Number of pages8
JournalPhysical Chemistry Chemical Physics
Volume12
Issue number16
DOIs
Publication statusPublished - 2010

ASJC Scopus subject areas

  • General Physics and Astronomy
  • Physical and Theoretical Chemistry

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