Information card for entry 2011977

Structure parameters

• Chemical name: tribarium diantimonide oxide
• Formula: Ba3 O Sb2
• Calculated formula: Ba3 O Sb2
• SMILES: [Ba+2].[Sb-2][Sb-2].[Ba+2].[O-2].[Ba+2]
• Title of publication: Barium antimonide oxide, Ba~3~Sb~2~O
• Authors of publication: Boss, Michael; Pickhard, Frank; Zumdick, Markus; Röhr, Caroline
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 5
• Pages of publication: 503 - 504
• a: 12.4228 ± 0.0011 Å
• b: 12.63 ± 0.003 Å
• c: 5.101 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 800.3 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 55
• Hermann-Mauguin space group symbol: P b a m
• Hall space group symbol: -P 2 2ab
• Residual factor for all reflections: 0.039
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for all reflections included in the refinement: 0.078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.228
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes