Information card for entry 4326243

Structure parameters

• Formula: C104 H122 As8 Cu8 Mo24 N48 O93
• Calculated formula: C104 H120 As8 Cu8 Mo24 N48 O93
• Title of publication: First Three-Dimensional Inorganic-Organic Hybrid Material Constructed From an "Inverted Keggin" Polyoxometalate and a Copper(I)-Organic Complex
• Authors of publication: Bo Liu; Zhen-Tao Yu; Jin Yang; Wu Hua; Ying-Ying Liu; Jian-Fang Ma
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 8967 - 8972
• a: 20.7511 ± 0.0002 Å
• b: 20.7511 ± 0.0002 Å
• c: 43.0804 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 18550.8 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0904
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.1109
• Weighted residual factors for all reflections included in the refinement: 0.1244
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No