Abstract

A valence force field calculation for the out-of-plane modes of tetracyanoethylene is reported, which makes possible a straightforward assignment of the low-frequency vibrations, including several in-plane modes which previously could not be assigned with certainty. The present set of assignments is consistent with observed vibrational spectra, both for uncomplexed and for complexed tetracyanoethylene, and, for the planar vibrations, is supported by recently published force constant calculations.

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