Journal of the American Chemical Society · 2007 · 22 citations · 12 references
Natural SciencesChemistryPhysicsMolecular PhysicsSpectroscopic AnalysisSpectroscopyEmission SpectroscopyInterstellar ChemistryInterstellar GasInterstellar MoleculesMolecular Orbital TheoryMolecular SpectroscopyEmission SpectraInterstellar Molecule IdentificationLaser-induced FluorescenceLaser-induced Fluorescence SpectroscopySpectroscopic IdentificationSpectroscopy Of Interstellar MoleculesSupersonic Jet SpectroscopyVibrational Frequencies
The first spectroscopic evidence for the existence of the CCP and CCAs free radicals has been obtained from laser-induced fluorescence and wavelength-resolved emission spectra acquired in supersonic discharge jet experiments. The observed vibrational frequencies, 13 C isotope effects, spin−orbit splittings, and rotational band contours have been used to positively identify the radicals. The measured ground state vibrational frequencies are in accord with our density functional molecular orbital theory predictions. The CCP species, which has a large calculated dipole moment, is a possible interstellar molecule that may be detectable by radioastronomy.
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Density-functional thermochemistry. III. The role of exact exchange
Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations
Natural Sciences, Chemistry, Physics +13
ABSORPTION SPECTRUM OF THE CCN RADICAL
A. J. Merer, D. N. Travis · Canadian Journal of Physics · 1965 · 149 citations
Natural Sciences, Chemistry, Physics +17