Information card for entry 1559745

Structure parameters

• Formula: C18 H18 Al0.5 Mo6 N3 O34.25 P4
• Calculated formula: C18 H27 Al0.5 Mo6 N3 O34.25 P4
• Title of publication: Stable monovalent aluminum(i) in a reduced phosphomolybdate cluster as an active acid catalyst.
• Authors of publication: Zhang, Ya-Qi; Zhou, Lai-Yun; Ma, Yuan-Yuan; Dastafkan, Kamran; Zhao, Chuan; Wang, Lan-Zhi; Han, Zhan-Gang
• Journal of publication: Chemical science
• Year of publication: 2020
• Journal volume: 12
• Journal issue: 5
• Pages of publication: 1886 - 1890
• a: 11.438 ± 0.002 Å
• b: 23.034 ± 0.004 Å
• c: 15.788 ± 0.003 Å
• α: 90°
• β: 95.203 ± 0.003°
• γ: 90°
• Cell volume: 4142.4 ± 1.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 7
• 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: 0.0403
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.084
• Weighted residual factors for all reflections included in the refinement: 0.0878
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No