The hyperfine coupling constants of the cyclohexyl radical have been calculated for several different geometries using Pople–Santry molecular orbital theory. The results indicate that a slightly nonplanar geometry for the radical carbon atom is required to account for the observed splittings.
A. Hudson, H. A. Hussain and J. N. Murrell, J. Chem. Soc. A, 1968, 2336 DOI: 10.1039/J19680002336
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