Information card for entry 4323897

Structure parameters

• Common name: cesium copper selenosulfide
• Formula: Cs Cu S1.6 Se4.4
• Calculated formula: Cs2 Cu2 S3.199 Se8.801
• 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: 11.253 ± 0.004 Å
• b: 11.585 ± 0.002 Å
• c: 7.2107 ± 0.0015 Å
• α: 92.93 ± 0.02°
• β: 100.94 ± 0.02°
• γ: 74.51 ± 0.02°
• Cell volume: 889.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1049
• Residual factor for significantly intense reflections: 0.0744
• Weighted residual factors for all reflections: 0.2067
• Weighted residual factors for significantly intense reflections: 0.1962
• Goodness-of-fit parameter for all reflections: 1.032
• Goodness-of-fit parameter for significantly intense reflections: 1.227
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No