Information card for entry 4001537

Structure parameters

• Formula: Cs2 Ga6 H5.1 O27.55 P6
• Calculated formula: Cs2 Ga6 H2 O27.549 P6
• Title of publication: Unusual Mobility of Cesium via a Reversible Topotactic Dehydration Reaction in a New Hydroxygallophosphate with an Intersecting Tunnel Structure
• Authors of publication: Lesage, J.; Guesdon, A.; Hervieu, M.; Raveau, B.
• Journal of publication: Chemistry of Materials
• Year of publication: 2006
• Journal volume: 18
• Journal issue: 12
• Pages of publication: 2895
• a: 10.219 ± 0.0004 Å
• b: 13.9566 ± 0.0015 Å
• c: 17.26 ± 0.002 Å
• α: 90°
• β: 90.193 ± 0.005°
• γ: 90°
• Cell volume: 2461.7 ± 0.4 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0911
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.0396
• Weighted residual factors for all reflections included in the refinement: 0.0443
• Goodness-of-fit parameter for significantly intense reflections: 1.33
• Goodness-of-fit parameter for all reflections included in the refinement: 1.17
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No