Conformation of radicals in a γ- irradiated linear perfluoroalkane at 77 K

High Energy Chemistry - Tập 34 - Trang 145-150 - 2000
S. R. Allayarov1, I. M. Barkalov1, A. I. Mikhailov1
1Institute for Chemical Physics Research, Russian Academy of Sciences, Chernogolovka, Moscow oblast, Russia

Tóm tắt

The principal geometrical parameters of the carbon skeleton of ~CF2CFCF2~ and ~CF2CF2 radicals at 77 K show good agreement with spiral configuration of a perfluoroalkane molecule in crystal. The conformations of radicals resulting from fluorine atom abstraction or C-C bond cleavage are determined by minimum of bond rotation potential energy in a linear perfluoroalkane helix. The analysis of the spectrum of ~CF2CFCF2~ and ~CF2CF2 radicals formed in γ-irradiated linear n-perfluorododecane and polytetrafluoroethylene was performed. The conformational angles and hyperfine coupling constants were determined for α- and Β-fluorine atoms at 77 K.

Tài liệu tham khảo

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