Information card for entry 2018405

Structure parameters

• Chemical name: pentalead octaindium dibismuth icosasulfide
• Formula: Bi1.62 In8.38 Pb5 S20
• Calculated formula: Bi1.622 In8.378 Pb5 S20
• Title of publication: Pb~5.0(1)~In~8.4(1)~Bi~1.6(1)~S~20~, a new quaternary lead indium bismuth sulfide
• Authors of publication: Reis, I.; Krämer, V.; Seiler, A.; Topa, D.; Keller, E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 3
• Pages of publication: i12 - i16
• a: 27.065 ± 0.004 Å
• b: 3.8825 ± 0.0003 Å
• c: 15.683 ± 0.002 Å
• α: 90°
• β: 103.59 ± 0.01°
• γ: 90°
• Cell volume: 1601.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0407
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0849
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No