Information card for entry 4310848

Structure parameters

• Formula: C3 H11 Al3 Mn N O18 P4
• Calculated formula: C3 H7 Al3 Mn N O18 P4
• Title of publication: [C6N2H14]0.5.[MnAl3(PO4)4(H2O)2]: A Manganese(II)-Substituted Aluminophosphate with AFN Topology
• Authors of publication: Lei Shi; Jiyang Li; Jihong Yu; Yi Li; Hong Ding; Ruren Xu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 2703 - 2707
• a: 9.5121 ± 0.0006 Å
• b: 9.8819 ± 0.0006 Å
• c: 12.1172 ± 0.0007 Å
• α: 70.533 ± 0.004°
• β: 73.473 ± 0.004°
• γ: 82.328 ± 0.004°
• Cell volume: 1028.57 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0794
• Residual factor for significantly intense reflections: 0.0586
• Weighted residual factors for significantly intense reflections: 0.1693
• Weighted residual factors for all reflections included in the refinement: 0.1877
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No