Information card for entry 4311129

Structure parameters

• Formula: As2 Cs4 Mn S8
• Calculated formula: As2 Cs4 Mn S8
• Title of publication: [Mn2(AsS4)4]8- and [Cd2(AsS4)2(AsS5)2]8-: Discrete Clusters with High Negative Charge from Alkali Metal Polythioarsenate Fluxes
• Authors of publication: Ratnasabapathy G. Iyer; Mercouri G. Kanatzidis
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 3656 - 3662
• a: 9.42 ± 0.005 Å
• b: 9.559 ± 0.005 Å
• c: 11.496 ± 0.007 Å
• α: 105.606 ± 0.014°
• β: 102.999 ± 0.012°
• γ: 92.423 ± 0.014°
• Cell volume: 965.6 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0475
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1224
• Weighted residual factors for all reflections included in the refinement: 0.1254
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No