Information card for entry 7025302

Structure parameters

• Formula: C16 H78 Cu5 N16 O68 P2 W17
• Calculated formula: C16 H64 Cu5 N16 O68 P2 W17
• Title of publication: Controlling the synthesis of novel chiral polyoxometalate-based compounds and racemic compounds from the same system.
• Authors of publication: Zhang, Yi; Zhang, Ling; Hao, Zhaomin; Luo, Fang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 30
• Pages of publication: 7012 - 7016
• a: 11.86 ± 0.005 Å
• b: 13.268 ± 0.005 Å
• c: 31.027 ± 0.005 Å
• α: 81.04 ± 0.005°
• β: 86.925 ± 0.005°
• γ: 66.374 ± 0.005°
• Cell volume: 4418 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1086
• Residual factor for significantly intense reflections: 0.0777
• Weighted residual factors for significantly intense reflections: 0.1924
• Weighted residual factors for all reflections included in the refinement: 0.2057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No