Information card for entry 2107470

Structure parameters

• Formula: Cs3 O15 Sc Si6
• Calculated formula: Cs3 O15 Sc Si6
• Title of publication: (3+1)-Incommensurately modulated crystal structure of Cs~3~ScSi~6~O~15~
• Authors of publication: Hejny, Clivia; Kahlenberg, Volker; Schmidmair, Daniela; Dabić, Predrag
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 1
• Pages of publication: 109 - 116
• a: 13.8611 ± 0.0013 Å
• b: 13.8611 ± 0.0013 Å
• c: 6.9924 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1163.5 ± 0.2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 166
• Hermann-Mauguin space group symbol: R -3 m :H
• Hall space group symbol: -R 3 2"
• Residual factor for all reflections: 0.0289
• Residual factor for significantly intense reflections: 0.02
• Weighted residual factors for significantly intense reflections: 0.0235
• Weighted residual factors for all reflections included in the refinement: 0.0259
• Goodness-of-fit parameter for significantly intense reflections: 1.16
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No