Information card for entry 7709999

Structure parameters

• Common name: Pb5Sn3Se10Cl2
• Formula: Cl2 Pb5 Se10 Sn3
• Calculated formula: Cl2 Pb5 Se10 Sn3
• Title of publication: AIn4S6Cl (A = Rb and Cs) and Pb5Sn3Q10Cl2 (Q = S and Se): quaternary chalcohalides with mixed anionic coordination exhibit photocurrent responses
• Authors of publication: Jiang, Lin-Tao; Li, Ming-Ze; Jiang, Xiao-Ming; Liu, Bin-Wen; Guo, Guo-Cong
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 21.2415 ± 0.0009 Å
• b: 12.3226 ± 0.0005 Å
• c: 4.0333 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1055.72 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 65
• Hermann-Mauguin space group symbol: C m m m
• Hall space group symbol: -C 2 2
• Residual factor for all reflections: 0.0548
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.1106
• Weighted residual factors for all reflections included in the refinement: 0.1119
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No