K. Tabayashi et K. Akasaka, NATURAL-ABUNDANCE H-2 NMR FOR LIQUID-CRYSTAL STUDIES - APPLICATION TO4'-(HEXYLOXY)-4-CYANOBIPHENYL, JOURNAL OF PHYSICAL CHEMISTRY B, 101(26), 1997, pp. 5108-5111
Quadrupolar splitting In deuterium NMR (H-2 NMR) is a powerful means t
o evaluate microscopic orientational orders of liquid crystals. So far
, because of the low sensitivity of H-2 NMR at natural abundance, appl
ication of H-2 NMR to liquid crystals has been considered possible onl
y for samples with deuterium enrichment. However, in the present work,
we show that by taking advantage of the high sensitivity of a recent
high-field NMR spectrometer, detection of H-2 NMR signals al the natur
al abundance of the H-2 isotope is possible under proton decoupling, A
ssignments of the H-2 NMR signals to specific chemical groups in the m
olecule may be made by comparing H-2 chemical shift in the liquid crys
talline phase with those of H-1 chemical shift in the isotropic phase,
Subsequent evaluation of quadrupolar splittings gives microscopic ori
entational orders of the molecule, With this technique, temperature de
pendence of microscopic orders of 4'-(hexyloxy)-4-cyanobiphenyl is dem
onstrated.