Information card for entry 4311686

Structure parameters

• Formula: Ba2 Bi3
• Calculated formula: Ba2 Bi3
• Title of publication: Nonclassical Bonding in the Novel Structure of Ba2Bi3 and Unexpected Site Preference in the Coloring Variant Ba2BiSb2
• Authors of publication: Siméon Ponou; Thomas F. Fässler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 6124 - 6126
• a: 4.8186 ± 0.0015 Å
• b: 7.989 ± 0.004 Å
• c: 9.982 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 384.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 2
• Space group number: 71
• Hermann-Mauguin space group symbol: I m m m
• Hall space group symbol: -I 2 2
• Residual factor for all reflections: 0.0898
• Residual factor for significantly intense reflections: 0.0702
• Weighted residual factors for significantly intense reflections: 0.1959
• Weighted residual factors for all reflections included in the refinement: 0.2047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No