Abstract
According to the data from the photoelectron spectra and the MNDO calculations, the orbitals of the functional group and the upper π-orbitals of the ring in the compounds C6F5X with X=NCO and N3 interact; however, their interaction is less effective than the interaction in the molecules of the hydrocarbon analogs; when X=NO2, NO, CHO, COCH3, COCF3, and CF3, the π orbitals of the substituent and the upper π orbitals of the ring do not interact.
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