Information card for entry 1515490

Structure parameters

• Formula: C21 H32 Mn4 O14
• Calculated formula: C21 H32 Mn4 O14
• Title of publication: Evolution of the structures and magnetic properties of the manganese dicarboxylates, Mn2(CO2(CH2)nCO2)(OH)2 and Mn4(CO2(CH2)nCO2)3(OH)2
• Authors of publication: Saines, Paul J.; Jain, Prashant; Cheetham, Anthony K.
• Journal of publication: Chemical Science
• Year of publication: 2011
• Journal volume: 2
• Journal issue: 10
• Pages of publication: 1929
• a: 5.0585 ± 0.0003 Å
• b: 12.4647 ± 0.0007 Å
• c: 20.8241 ± 0.0009 Å
• α: 90.848 ± 0.004°
• β: 90.047 ± 0.004°
• γ: 90.77 ± 0.005°
• Cell volume: 1312.75 ± 0.12 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0807
• Residual factor for significantly intense reflections: 0.0709
• Weighted residual factors for significantly intense reflections: 0.1955
• Weighted residual factors for all reflections included in the refinement: 0.2035
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No