When referring to the Spectral Atlas, please cite our publication:
Keller-Rudek, H., Moortgat, G. K., Sander, R., and Sörensen,
R.: The MPI-Mainz UV/VIS spectral atlas of gaseous molecules of
atmospheric interest, Earth Syst. Sci. Data, 5, 365–373, (2013),
DOI: 10.5194/essd-5-365-2013
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DATAFILE: | CH3CHOO_IUPAC(2015)_298K_280-455nm(rec,fit).txt |
NAME: | acetaldehyde oxide |
FORMULA: | CH3CHOO |
AUTHOR(YEAR): | IUPAC(2015) |
T: | 298K |
λ: | 280-455nm(rec,fit) |
BIBLIOGRAPHY: |
M. Ammann, R. A. Cox, J. N. Crowley, H. Herrmann, E. Jenkin, V.F. McNeill, A. Mellouki, M. J. Troe, T. J. Wallington, "Task Group on Atmospheric Chemical Kinetic Data Evaluation – Evaluated Kinetic Data",
http://iupac.pole-ether.fr
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COMMENTS: | IUPAC(2015) recommendation:
the absorption cross sections have been calculated using the Gaussian fit
σ(λ) = 1.25316 × 10-17 × exp [-0.000460967 × (328.28 - λ)2]
to the data of
M.C. Smith, W.-L. Ting, C.-H. Chang, K. Takahashi, K.A. Kristie A. Boering, and J.J.-M. Lin, "UV absorption spectrum of the C2 Criegee intermediate CH3HOO," J. Chem. Phys. 141, 074302-1 - 074302-7 (2014); http://doi.org/10.1063/1.4892582
The listed "preferred values" are erroneous (those of CH2OO)
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