Information card for entry 4304079

Structure parameters

• Formula: C52 H95.5 Cl Cu2 Mo12 N8 O62 P
• Calculated formula: C52 H56 Cl Cu2 Mo12 N8 O46 P
• Title of publication: Self-Assembly of Organic-Inorganic Hybrid Materials Constructed from Eight-Connected Coordination Polymer Hosts with Nanotube Channels and Polyoxometalate Guests As Templates
• Authors of publication: Xiuli Wang; Yanfeng Bi; Baokuan Chen; Hongyan Lin; Guocheng Liu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 2442 - 2448
• a: 24.2146 ± 0.0012 Å
• b: 24.2146 ± 0.0012 Å
• c: 18.6339 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10925.9 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 86
• Hermann-Mauguin space group symbol: P 42/n :2
• Hall space group symbol: -P 4bc
• Residual factor for all reflections: 0.1247
• Residual factor for significantly intense reflections: 0.072
• Weighted residual factors for significantly intense reflections: 0.1804
• Weighted residual factors for all reflections included in the refinement: 0.2161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No