Information card for entry 4514279

Structure parameters

• Formula: Cu2 Gd4 H114 O105 W19 Zn3
• Calculated formula: Cu2 Gd4 O105 W19 Zn3
• Title of publication: Structural Transformation of Porous Polyoxometalate Frameworks and Highly Efficient Biomimetic Aerobic Oxidation of Aliphatic Alcohols
• Authors of publication: Zhao, Min; Zhang, Xian-Wei; Wu, Chuan-De
• Journal of publication: ACS Catalysis
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 10
• Pages of publication: 6573
• a: 12.3498 ± 0.0013 Å
• b: 13.2731 ± 0.0013 Å
• c: 16.0314 ± 0.0011 Å
• α: 68.011 ± 0.008°
• β: 70.892 ± 0.008°
• γ: 69.811 ± 0.009°
• Cell volume: 2226.9 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1359
• Residual factor for significantly intense reflections: 0.0913
• Weighted residual factors for significantly intense reflections: 0.2082
• Weighted residual factors for all reflections included in the refinement: 0.2351
• Goodness-of-fit parameter for all reflections included in the refinement: 1.266
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No