Information card for entry 2240183

Structure parameters

• Chemical name: Bis(propane-1,3-diaminium) hexafluoridoaluminate diaquatetrafluoridoaluminate tetrahydrate
• Formula: C6 H36 Al2 F10 N4 O6
• Calculated formula: C6 H36 Al2 F10 N4 O6
• Title of publication: Crystal structure of bis(propane-1,3-diaminium) hexafluoridoaluminate diaquatetrafluoridoaluminate tetrahydrate
• Authors of publication: Abdi, Insaf; Al-Sadhan, Khulood; Ben Ali, Amor
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 12
• Pages of publication: 471 - 473
• a: 12.975 ± 0.005 Å
• b: 25.115 ± 0.009 Å
• c: 6.452 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2102 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 65
• Hermann-Mauguin space group symbol: C m m m
• Hall space group symbol: -C 2 2
• Residual factor for all reflections: 0.0883
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1145
• Weighted residual factors for all reflections included in the refinement: 0.1479
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes