Information card for entry 4323898

Structure parameters

• Common name: cesium copper diselenodisulfide
• Formula: Cs Cu S2 Se2
• Calculated formula: Cs Cu S2.01 Se1.99
• Title of publication: Synthesis, Characterization, and Bonding of Two New Heteropolychalcogenides: α-CsCu(SxSe4-x) and CsCu(SxSe6-x)
• Authors of publication: Casey C. Raymond; Peter K. Dorhout
• Journal of publication: Inorganic Chemistry
• Year of publication: 1996
• Journal volume: 35
• Pages of publication: 5634 - 5641
• a: 5.439 ± 0.001 Å
• b: 8.878 ± 0.002 Å
• c: 13.762 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 664.5 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0472
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for all reflections: 0.0958
• Weighted residual factors for significantly intense reflections: 0.0919
• Goodness-of-fit parameter for all reflections: 1.07
• Goodness-of-fit parameter for significantly intense reflections: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No