Information card for entry 4347322

Structure parameters

• Formula: C65 H142 Cu Mo6 N4 O27
• Calculated formula: C65 H139 Cu Mo6 N4 O27
• Title of publication: Controlled Triol-Derivative Bonding and Decoration Transformation on Cu-Centered Anderson-Evans Polyoxometalates.
• Authors of publication: Wang, Yang; Li, Bao; Qian, Hujun; Wu, Lixin
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 9
• Pages of publication: 4271 - 4277
• a: 14.99 ± 0.004 Å
• b: 25.871 ± 0.005 Å
• c: 23.163 ± 0.005 Å
• α: 90°
• β: 105.561 ± 0.009°
• γ: 90°
• Cell volume: 8653 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.093
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1501
• Weighted residual factors for all reflections included in the refinement: 0.1675
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No