Information card for entry 4306901

Structure parameters

• Formula: Cs0.38 D2.8 H0.83 O8 Si Ti2
• Calculated formula: Cs0.375 D2.795 H0.83 O8 Si Ti2
• Title of publication: Role of the Hydroxyl-Water Hydrogen-Bond Network in Structural Transitions and Selectivity toward Cesium in Cs0.38(D1.08H0.54)SiTi2O7.(D0.86H0.14)2O Crystalline Silicotitanate
• Authors of publication: Aaron J. Celestian; John B. Parise; Ronald I. Smith; Brian H. Toby; Abraham Clearfield
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 1081 - 1089
• a: 7.86023 ± 0.00014 Å
• b: 7.86023 Å
• c: 11.9051 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 735.54 ± 0.03 ų
• Number of distinct elements: 6
• Space group number: 132
• Hermann-Mauguin space group symbol: P 42/m c m
• Hall space group symbol: -P 4c 2c
• Goodness-of-fit parameter for all reflections: 2.53
• Method of determination: powder diffraction
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No