R. Berardi et al., A NEW MAXIMUM-ENTROPY CONFORMATIONAL-ANALYSIS OF BIPHENYL IN LIQUID-CRYSTAL SOLUTION, Molecular crystals and liquid crystals science and technology. Section A, Molecular crystals and liquid crystals, 290, 1996, pp. 245-253
We use the maximum entropy internal order (MEIO) method to reanalyze p
ublished (1)HNMR dipolar couplings for biphenyl dissolved in nematic s
olvents allowing for geometry variations with dihedral angle phi. We f
ind that all present experimental data are consistent with similar con
formational distributions with a maximum at phi = 34 - 35 degrees. Lit
tle rotational-conformational coupling has been found.