Information card for entry 4344068

Structure parameters

• Formula: Ba In9 Ir2
• Calculated formula: Ba In9 Ir2
• Title of publication: Synthesis, Structure, and Rigid Unit Mode-like Anisotropic Thermal Expansion of BaIr2In9.
• Authors of publication: Calta, Nicholas P.; Han, Fei; Kanatzidis, Mercouri G.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 17
• Pages of publication: 8794 - 8799
• a: 8.8548 ± 0.0006 Å
• b: 8.8548 ± 0.0006 Å
• c: 4.2696 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 289.92 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 191
• Hermann-Mauguin space group symbol: P 6/m m m
• Hall space group symbol: -P 6 2
• Residual factor for all reflections: 0.0236
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for significantly intense reflections: 0.0569
• Weighted residual factors for all reflections included in the refinement: 0.0569
• Goodness-of-fit parameter for all reflections included in the refinement: 1.473
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No