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Electronic and Geometrical Structure of Se5, Se6, Se7, and Se8

Abstract The vacuum-UV-photoelectron spectra of Se2, Se5, Se6, Se7, and Se8 have been recorded at a photon energy of h ν= 10.0 eV. The isolated molecules are examined in a supersonic molecular beam employing a new photoelectron-photoion coincidence technique. The structure of the photoelectron spectra of selenium molecules with even and odd numbers of atoms differs in a characteristic manner. While the spectra of Se6 and Se8 show one single broad band, three separated bands with different intensities are observed for Se5 and two for Se7. The spectra are compared to molecular orbital energy calculations based on theoretically supposed geometries. The comparison indicates that Se6 and Se8 have Dnd-symmetrical ring structures, whereas Se5 and Se7 are C1h-symmetrical rings