Information card for entry 1562201

Structure parameters

• Formula: F O10 Rb2 Sc Si4
• Calculated formula: F O10 Rb2 Sc Si4
• Title of publication: One-pot occurrence of two polymorphs of Rb 2 Sc[Si 4 O 10 ]F and their structural, spectroscopic and computational characterization
• Authors of publication: Kahlenberg, Volker; Manninger, Tanja; Perfler, Lukas; Többens, Daniel M.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2014
• Journal volume: 220
• Pages of publication: 79 - 90
• a: 11.2619 ± 0.0003 Å
• b: 11.2619 ± 0.0003 Å
• c: 8.3053 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1053.36 ± 0.06 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 87
• Hermann-Mauguin space group symbol: I 4/m
• Hall space group symbol: -I 4
• Residual factor for all reflections: 0.0235
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.0581
• Weighted residual factors for all reflections included in the refinement: 0.0585
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No