Information card for entry 4332039

Structure parameters

• Formula: C45 H60 Al N2 O5 P
• Calculated formula: C45 H60 Al N2 O5 P
• Title of publication: Aluminum Phosphinate and Phosphates of Salen Ligands
• Authors of publication: Mitra, Amitabha; Parkin, Sean; Atwood, David A.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 10
• Pages of publication: 3970 - 3975
• a: 11.685 ± 0.0002 Å
• b: 26.184 ± 0.0005 Å
• c: 28.1148 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8602 ± 0.3 ų
• Cell temperature: 90 ± 0.2 K
• Ambient diffraction temperature: 90 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0457
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No