Information card for entry 7219583

Structure parameters

• Formula: C4 H10 Mn4 N4 O16 P4
• Calculated formula: C4 H10 Mn4 N4 O16 P4
• Title of publication: Ionothermal synthesis of a new three-dimensional manganese(II) phosphate with DFT-zeotype structure
• Authors of publication: He, Yongke; Yan, Yan; Wu, Junbiao; Song, Xiaowei
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 14.958 ± 0.0018 Å
• b: 14.958 ± 0.0018 Å
• c: 9.05 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2024.9 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 77
• Hermann-Mauguin space group symbol: P 42
• Hall space group symbol: P 4c
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0853
• Weighted residual factors for all reflections included in the refinement: 0.0913
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No