T. Iijima et al., H-2 AND PT-195 NMR-STUDIES OF MOLECULAR AND ELECTRON-SPIN DYNAMICS INPARAMAGNETIC [CU(H2O)(6)][PTCL6], Zeitschrift fur Naturforschung. A, A journal of physical sciences, 53(6-7), 1998, pp. 447-452
The temperature dependences of H-2 and Pt-195 NMR spectra and the spin
-lattice relaxation time T-1 were measured for [Cu(H2O)(6)][PtCl6]. Fr
om the simulation of H-2 NMR spectra, the jump rate of 180 degrees fli
ps of the water molecules (k), the nuclear quadrupole interaction para
meters (e(2)Qq/h, eta) and the electron-nucleon dipolar interaction pa
rameter (nu(D)) were obtained. By measuring H-2 T-1, k was estimated i
n the temperature range where the spectrum is insensitive to the motio
n of the water molecules. Above the phase transition temperature, the
pre-exponential factor k(0) = 8 x 10(11) s(-1) and the activation ener
gy E-a = 15 kJ mol(-1) for 180 degrees flips of the water molecules we
re obtained from the spectral simulation and T-1. Pt-195 NMR spectra s
howed an axially symmetric and unsymmetric powder pattern of the chemi
cal shift anisotropy at the high and low temperature phase, respective
ly. For the deuterated compound, the correlation ti mes of the electro
n spin in Cu2+ were estimated from Pt-195 T-1 and the activation energ
y for jumping between the different configurations of Jahn-Teller dist
ortion Delta = 200 K was obtained.