Information card for entry 7034217

Structure parameters

• Formula: C13.5 H24 Mn3 N3 O20 P2
• Calculated formula: C13.5 H23.5 Mn3 N3 O20 P2
• Title of publication: Solvent-free synthesis of new inorganic-organic hybrid solids with finely tuned manganese oxalate structures.
• Authors of publication: Luan, Lindong; Li, Jing; Yin, Changzhen; Lin, Zhien; Huang, Hui
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 13
• Pages of publication: 5974 - 5977
• a: 8.0352 ± 0.0002 Å
• b: 10.1895 ± 0.0002 Å
• c: 16.0266 ± 0.0005 Å
• α: 93.349 ± 0.002°
• β: 94.504 ± 0.003°
• γ: 92.452 ± 0.002°
• Cell volume: 1304.41 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1225
• Weighted residual factors for all reflections included in the refinement: 0.1262
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No