Information card for entry 4343260

Structure parameters

• Formula: F K5 Mo4 O14
• Calculated formula: F K5 Mo4 O14
• SMILES: [K+].O=[Mo]12([O]([Mo](=O)(=O)=O)[Mo]([F]1)([O]2[Mo](=O)(=O)=O)(=O)(=O)=O)(=O)=O.[K+].[K+].[K+].[K+]
• Title of publication: K5Mo4O14F: A Novel Fluorinated Polyoxomolybdate and Its Structural Stability.
• Authors of publication: Gong, Pifu; Luo, Siyang; Kang, Lei; Jiang, Xingxing; Xu, Jing; Zhang, Guochun; Lin, Zheshuai; Wu, Yicheng; Chen, Chuangtian
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 13
• Pages of publication: 6066 - 6068
• a: 17.8632 ± 0.0006 Å
• b: 10.6729 ± 0.0003 Å
• c: 8.4569 ± 0.0003 Å
• α: 90°
• β: 98.128 ± 0.003°
• γ: 90°
• Cell volume: 1596.13 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0336
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.072
• Weighted residual factors for all reflections included in the refinement: 0.0742
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No