Information card for entry 1546292

Structure parameters

• Formula: C8 H44 Al N9 O16 P4
• Calculated formula: C8 H44 Al N9 O16 P4
• SMILES: P(=O)(O[Al](OP(=O)([O-])[O-])(OP(=O)([O-])[O-])OP(=O)([O-])[O-])([O-])[O-].[NH4+].[NH3+]CC[NH3+].[NH3+]CC[NH3+].[NH3+]CC[NH3+].[NH3+]CC[NH3+]
• Title of publication: Structure determination of (N2C2H10)4(NH4)AlP4O16 : a new aluminophosphate templated by ethylenediamine
• Authors of publication: Riou, D.; Loiseau, T.; Ferey, G.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 1992
• Journal volume: 99
• Pages of publication: 414 - 418
• a: 9.1545 ± 0.0005 Å
• b: 9.1545 ± 0.0005 Å
• c: 17.181 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1439.85 ± 0.13 ų
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 6
• Space group number: 82
• Hermann-Mauguin space group symbol: I -4
• Hall space group symbol: I -4
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for significantly intense reflections: 0.023
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No