Literature DB >> 12736063

High resolution spectroscopy of the nu(3) band of DCOOD.

Frank Madeja1, Andreas Hecker, Simon Ebbinghaus, Martina Havenith.   

Abstract

The rotation-vibration spectrum of DCOOD has been recorded in the carbonyl stretch (nu(3)) region. Using a standard S-reduced Watson Hamiltonian in the I(r) representation, 225 lines could be fitted to a vibrational-rotational band. A full set of molecular constants was obtained. The nu(3) band is found to be strongly perturbed in the K(a): 1<--1 and K(a): 2<--2 subband. The perturbation is attributed to a Fermi resonance with the 2nu(8) overtone band and Coriolis coupling to a combination band (nu(4)+nu(7)). The band center is determined to be 1725.1218(1) cm(-1) which is more than 10 cm(-1) shifted compared to previous studies.

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Year:  2003        PMID: 12736063     DOI: 10.1016/s1386-1425(02)00412-2

Source DB:  PubMed          Journal:  Spectrochim Acta A Mol Biomol Spectrosc        ISSN: 1386-1425            Impact factor:   4.098


  1 in total

1.  Stretching of cis-formic acid: warm-up and cool-down as molecular work-out.

Authors:  Katharina A E Meyer; Martin A Suhm
Journal:  Chem Sci       Date:  2019-05-16       Impact factor: 9.825

  1 in total

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