Angewandte Chemie International Edition · 2000 · 32 citations · 0 references
EngineeringDifferent Ionic StatesMethanolOrganic ChemistryComputational ChemistryChemistrySpectra-structure CorrelationChemical EngineeringComplete Hei-pe SpectraBiochemistryRadical (Chemistry)Physical ChemistryFirst Experimental ObservationReactivity (Chemistry)Quantum ChemistryMolecular ChemistryDifferent Ionized StatesNatural SciencesSitu Spectroscopy
In situ spectroscopy and calculations agree on the characterization of the pyrolytically produced CH3S. and CH3O. radicals. The complete HeI-PE spectra of both radicals are in agreement with density functional theory calculations in both the position, shape, and intensity of the bands. The different ionized states for both radicals (three of them in the lower energy region resulting from ionization of the HOMO) are, therefore, unambiguously assigned.