Information card for entry 8102934

Structure parameters

• Chemical name: dipotassium octa-μ~3~-bromohexabromo-octahedro-hexamolybdenate
• Formula: Br14 K2 Mo6
• Calculated formula: Br14 K2.005 Mo6
• Title of publication: Crystal structure of dipotassium octakis(μ~3~-bromo)-hexabromo- octahedro-hexamolybdenate, K~2~[Mo~6~Br~14~]
• Authors of publication: Xu, W.; Wang, P.; Zheng, Y.-Q.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2006
• Journal volume: 221
• Journal issue: 2
• Pages of publication: 107 - 108
• a: 13.8 ± 0.0016 Å
• b: 13.8 ± 0.0016 Å
• c: 13.8 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2628.1 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 201
• Hermann-Mauguin space group symbol: P n -3 :2
• Hall space group symbol: -P 2ab 2bc 3
• Residual factor for all reflections: 0.1192
• Residual factor for significantly intense reflections: 0.0768
• Weighted residual factors for significantly intense reflections: 0.1483
• Weighted residual factors for all reflections included in the refinement: 0.1862
• Goodness-of-fit parameter for all reflections included in the refinement: 0.931
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No