We use the maximum entropy internal order (MEIO) method to reanalyze published (1)HNMR dipolar couplings for biphenyl dissolved in nematic solvents allowing for geometry variations with dihedral angle phi. We find that all present experimental data are consistent with similar conformational distributions with a maximum at phi = 34 - 35 degrees. Little rotational-conformational coupling has been found.
A new maximum entropy conformational analysis of biphenyl in liquid crystal solution / R., Berardi; Spinozzi, Francesco; AND C., Zannoni. - In: MOLECULAR CRYSTALS AND LIQUID CRYSTALS. - ISSN 1563-5287. - STAMPA. - 290:(1996), pp. 245-254.
A new maximum entropy conformational analysis of biphenyl in liquid crystal solution
SPINOZZI, Francesco;
1996-01-01
Abstract
We use the maximum entropy internal order (MEIO) method to reanalyze published (1)HNMR dipolar couplings for biphenyl dissolved in nematic solvents allowing for geometry variations with dihedral angle phi. We find that all present experimental data are consistent with similar conformational distributions with a maximum at phi = 34 - 35 degrees. Little rotational-conformational coupling has been found.File in questo prodotto:
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