Information card for entry 4030714

Structure parameters

• Formula: Cl13 Nb6 O3 Sc
• Calculated formula: Cl13 Nb6 O3 Se
• Title of publication: Structure of the first ternary oxohalide with the Nb6 cluster: ScNb6Cl13O3
• Authors of publication: Cordier, S.; Perrin, C.; Sergent, M.
• Journal of publication: European Journal of Solid State and Inorganic Chemistry
• Year of publication: 1994
• Journal volume: 31
• Pages of publication: 1049 - 1060
• a: 9.086 ± 0.002 Å
• b: 9.086 ± 0.002 Å
• c: 52.4 ± 0.02 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4326 ± 2 ų
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• Space group number: 98
• Hermann-Mauguin space group symbol: I 41 2 2
• Hall space group symbol: I 4bw 2bw
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No