T. Ueda et al., C-13 CP MAS NMR-STUDY OF THE LAYERED COMPOUNDS [C6H5CH2CH2NH3](2)[CH3NH3]N-1PBNI3N+1 (N =1, 2)/, Zeitschrift fur Naturforschung. A, A journal of physical sciences, 51(8), 1996, pp. 910-914
C-13 CP/MAS NMR spectra were measured on the layered compounds [C6H5CH
2CH2NH3](2)[CH3NH3]n-1PbnI3n+1 (n = 1, 2). The linewidth of the resona
nce peak corresponding to the phenyl carbons changed with temperature.
The maximum broadening took place at 363 K for both compounds. The ac
tivation energy E(a) for the reorientation of the phenyl group was det
ermined to be 25 kJ mol(-1) for n = 1 and 26 kJ mol(-1) for n = 2. The
frequency factor tau(0) was evaluated from the linewidth at 363 K. Th
e value of the second moment, estimated from the maximum linewidth, wa
s interpreted by assuming a 180 degrees flip of the phenyl group aroun
d its two-fold axis. The similarity of the activation energies for the
reorientation of the phenyl group suggested that the local structure
and the molecular motion of the organic cations is little affected by
the difference in the sub-structure of the inorganic layer in those co
mpounds.