Information card for entry 1563553

Structure parameters

• Common name: SIZ-18
• Formula: C7 H10 Al N O8 P2
• Calculated formula: C7 H10 Al N O8 P2
• Title of publication: Ionothermal synthesis and crystal structures of metal phosphate chains
• Authors of publication: Wragg, David S.; Le Ouay, Benjamin; Beale, Andrew M.; O-Brien, Matthew G.; Slawin, Alexandra M.Z.; Warren, John E.; Prior, Timothy J.; Morris, Russell E.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2010
• Journal volume: 183
• Journal issue: 7
• Pages of publication: 1625 - 1631
• a: 7.8237 ± 0.0014 Å
• b: 14.2901 ± 0.0017 Å
• c: 12.7884 ± 0.0014 Å
• α: 90°
• β: 118.184 ± 0.014°
• γ: 90°
• Cell volume: 1260.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0647
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.1267
• Weighted residual factors for all reflections included in the refinement: 0.1338
• Goodness-of-fit parameter for all reflections included in the refinement: 1.145
• Diffraction radiation wavelength: 1.54051 Å
• Diffraction radiation type: copper
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No