Information card for entry 7204654

Structure parameters

• Common name: methylammonium zinc phosphate
• Formula: C H6 N O12 P3 Zn4
• Calculated formula: C H6 N O12 P3 Zn4
• Title of publication: Two novel open-framework zinc phosphates: (CH3NH3)Zn4(PO4)3 and (CH3NH3)2Zn5(PO4)4Electronic supplementary information (ESI) available: tables for atomic coordinates and anisotropic parameters and full list of bond lengths and bond angles. See http://www.rsc.org/suppdata/jm/b3/b303910b/
• Authors of publication: Song, Yanning; Zavalij, Peter Y.; Whittingham, M. Stanley
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2003
• Journal volume: 13
• Journal issue: 8
• Pages of publication: 1936
• a: 14.6797 ± 0.0006 Å
• b: 10.1204 ± 0.0004 Å
• c: 16.6015 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2466.39 ± 0.17 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0274
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.0542
• Weighted residual factors for all reflections included in the refinement: 0.0555
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No