Information card for entry 4319127

Structure parameters

• Formula: Sb8 Ti1.13 Zr3.88
• Calculated formula: Sb8 Ti1.13 Zr3.87
• Title of publication: A Three-Dimensional Extended Sb Network in the Metallic Antimonides (M',Ti)5Sb8 (M' = Zr, Hf, Nb, Mo)
• Authors of publication: Holger Kleinke
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 95 - 100
• a: 6.7106 ± 0.0006 Å
• b: 6.7106 ± 0.0006 Å
• c: 26.797 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1206.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 98
• Hermann-Mauguin space group symbol: I 41 2 2
• Hall space group symbol: I 4bw 2bw
• Residual factor for all reflections: 0.0942
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for all reflections: 0.1198
• Weighted residual factors for significantly intense reflections: 0.1063
• Goodness-of-fit parameter for all reflections: 0.91
• Goodness-of-fit parameter for significantly intense reflections: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No