Information card for entry 4313423

Structure parameters

• Formula: C4 H15 Al N2 O7 P2
• Calculated formula: C4 H15 Al N2 O7 P2
• Title of publication: Synthesis and Characterization of Three Novel Cation-Containing (NH4+/C3H7NH3+/NH3+C2H4NH3+) Aluminum Diphosphonates
• Authors of publication: Howard G. Harvey; Simon J. Teat; Chiu C. Tang; Lachlan M. Cranswick; Martin P. Attfield
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 2428 - 2439
• a: 11.142 ± 0.003 Å
• b: 7.0078 ± 0.0018 Å
• c: 12.903 ± 0.003 Å
• α: 90°
• β: 96.24 ± 0.006°
• γ: 90°
• Cell volume: 1001.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for all reflections included in the refinement: 0.126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.6893 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No