Photoionization of 1,1-difluoroethane: The structure of the C2H3F2+ ions
Autor: | Thomas Heinis, Kurt Börlin, René Bär, Martin Jungen |
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Rok vydání: | 1984 |
Předmět: |
chemistry.chemical_compound
Chemistry Ab initio quantum chemistry methods Physics::Atomic and Molecular Clusters Analytical chemistry General Physics and Astronomy 1 1-Difluoroethane Photoionization Physical and Theoretical Chemistry Neutral systems Conformational isomerism Standard enthalpy of formation Ion |
Zdroj: | Chemical Physics Letters. 105:327-331 |
ISSN: | 0009-2614 |
Popis: | In order to explain the photoionization efficiency curve of the ions with m/e = 65 from CH 3 CHF 2 , we have carried out ab initio calculations predicting energy differences and structural parameters for different isomers and conformers of both the neutral system and the ion. Also, some heats of formation are estimated. |
Databáze: | OpenAIRE |
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