Information card for entry 4110688

Structure parameters

• Common name: Compound X
• Formula: Cu3.42 Mn O2 S3 Sr2
• Calculated formula: Cu3.424 Mn O2 S3 Sr2
• Title of publication: Structural Chemistry and Metamagnetism of an Homologous Series of Layered Manganese Oxysulfides
• Authors of publication: Zoltán A. Gál; Oliver J. Rutt; Catherine F. Smura; Timothy P. Overton; Nicolas Barrier; Simon J. Clarke; Joke Hadermann
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 8530 - 8540
• a: 4.0217 ± 0.0001 Å
• b: 4.0217 ± 0.0001 Å
• c: 11.418 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 184.676 ± 0.008 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 123
• Hermann-Mauguin space group symbol: P 4/m m m
• Hall space group symbol: -P 4 2
• Residual factor for all reflections: 0.0213
• Residual factor for significantly intense reflections: 0.0182
• Weighted residual factors for significantly intense reflections: 0.0391
• Weighted residual factors for all reflections included in the refinement: 0.0407
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No