Information card for entry 1519065

Structure parameters

• Formula: Br2 F12 Pb7
• Calculated formula: Br2 F12 Pb7
• SMILES: [Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Br-].[Br-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-]
• Title of publication: Hydrothermal synthesis and structure of the ordered modification of Pb7F12Br2
• Authors of publication: F. Kubel; H. Vollenkle
• Journal of publication: Solid State Sciences
• Year of publication: 2000
• Journal volume: 2
• Pages of publication: 193 - 196
• a: 10.356 ± 0.002 Å
• b: 10.356 ± 0.002 Å
• c: 4.0224 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 373.59 ± 0.13 ų
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 3
• Space group number: 174
• Hermann-Mauguin space group symbol: P -6
• Hall space group symbol: P -6
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.059
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No