Information card for entry 4310117

Structure parameters

• Common name: Barium Zinc Oxysulfide
• Formula: Ba O S Zn
• Calculated formula: Ba O S Zn
• Title of publication: Vertex-Linked ZnO2S2 Tetrahedra in the Oxysulfide BaZnOS: a New Coordination Environment for Zinc in a Condensed Solid
• Authors of publication: Sarah Broadley; Zoltán A. Gál; Furio Corà; Catherine F. Smura; Simon J. Clarke
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 9092 - 9096
• a: 3.9619 ± 0.0002 Å
• b: 12.8541 ± 0.0007 Å
• c: 6.1175 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 311.54 ± 0.03 ų
• Cell temperature: 240 ± 2 K
• Ambient diffraction temperature: 240 ± 2 K
• Number of distinct elements: 4
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0244
• Residual factor for significantly intense reflections: 0.0188
• Weighted residual factors for significantly intense reflections: 0.0364
• Weighted residual factors for all reflections included in the refinement: 0.0374
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No