Information card for entry 3500063

Structure parameters

• Formula: C6 H13 Mn O8
• Calculated formula: C6 H13 Mn O8
• Title of publication: Rietveld refinement of the crystal structure of manganese(III) triacetate dihydrate from x-ray powder diffraction data
• Authors of publication: Armel Le Bail
• Journal of publication: Personal communication to COD
• Year of publication: 2016
• a: 7.9489 ± 0.0004 Å
• b: 6.7664 ± 0.0003 Å
• c: 10.9689 ± 0.0005 Å
• α: 90°
• β: 106.406 ± 0.003°
• γ: 90°
• Cell volume: 565.95 ± 0.05 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor R(I) for significantly intense reflections: 4.1934
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No