Information card for entry 7212511

Structure parameters

• Formula: C12 H65 Mo18 N6 O86.5 P2
• Calculated formula: C12 H20 Mo18 N6 O86.5 P2
• Title of publication: Resolution of chiral polyoxoanion [P2Mo18O62]6− with histidine
• Authors of publication: Liu, Ding; Tan, Hua-Qiao; Chen, Wei-Lin; Li, Yang-Guang; Wang, En-Bo
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 7
• Pages of publication: 2044
• a: 15.314 ± 0.003 Å
• b: 15.585 ± 0.003 Å
• c: 16.984 ± 0.003 Å
• α: 90°
• β: 104.48 ± 0.03°
• γ: 90°
• Cell volume: 3924.8 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0677
• Residual factor for significantly intense reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.1681
• Weighted residual factors for all reflections included in the refinement: 0.1695
• Goodness-of-fit parameter for all reflections included in the refinement: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No