Abstract
Na 8(AlSiO 4) 6(ReO 4) 2 sodalite was synthesized using a hydrothermal method and its crystal structure was determined from Rietveld refinement of experimental X-ray powder diffraction data. The refinement showed that this compound adopts the cubic sodalite structure (space group P 4 ¯ 3 n , #218) with a = 9.1528 (1) Å. Raman spectroscopic measurements confirm the presence of tetrahedral ReO 4 - groups. Broadening of the asymmetric stretching and bending vibrational modes suggests the tetrahedra are slightly distorted from ideal T d symmetry in the sodalite lattice. MAS NMR of 29Si and 27Al nuclei showed single intense peaks at δ iso = −92.4 ppm and δ iso = 57.5 ppm, respectively, confirming the alternating Si, Al tetrahedral ordering in sodalite deduced from the structural data. Chemical shifts for 29Si and 27Al calculated using correlative structural parameters (56.6 ± 0.8 ppm and −92.3 ± 0.9 ppm) showed good agreement with measured data indicating the validity of data derived from the Rietveld structural refinement.
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