Information card for entry 4116778

Structure parameters

• Formula: H84 Mn4 Na8 O108 Te2 W18
• Calculated formula: Mn4 Na8 O110 Te2 W18
• Title of publication: Highly Efficient Catalysts in Directed Oxygen-Transfer Processes: Synthesis, Structures of Novel Manganese-Containing Heteropolyanions, and Applications in Regioselective Epoxidation of Dienes with Hydrogen Peroxide
• Authors of publication: Michael Bösing; Andreas Nöh; Ina Loose; Bernt Krebs
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 1998
• Journal volume: 120
• Pages of publication: 7252 - 7259
• a: 12.456 ± 0.002 Å
• b: 12.812 ± 0.003 Å
• c: 29.579 ± 0.006 Å
• α: 90°
• β: 100.67 ± 0.03°
• γ: 90°
• Cell volume: 4638.8 ± 1.7 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0606
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for all reflections: 0.1071
• Weighted residual factors for significantly intense reflections: 0.1
• Goodness-of-fit parameter for all reflections: 1.043
• Goodness-of-fit parameter for significantly intense reflections: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No