Information card for entry 7209065

Structure parameters

• Formula: C90 H92 Cu2 N18 O126 Si3 W36
• Calculated formula: C90 H72 Cu2 N18 O126 Si3 W36
• Title of publication: The syntheses, structures and characterizations of a series of frameworks constructed from polyoxometalates, metals and organic units
• Authors of publication: Wang, Yan; Wang, La-Mei; Li, Zhi-Fang; Hu, Yang-Yang; Li, Guang-Hua; Xiao, Li-Na; Wang, Tie-gang; Zheng, Da-Fang; Cui, Xiao-Bing; Xu, Ji-Qing
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 2
• Pages of publication: 285
• a: 12.2184 ± 0.0012 Å
• b: 17.9919 ± 0.0018 Å
• c: 21.077 ± 0.002 Å
• α: 68.66 ± 0.002°
• β: 86.836 ± 0.002°
• γ: 83.211 ± 0.002°
• Cell volume: 4285.1 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0879
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1302
• Weighted residual factors for all reflections included in the refinement: 0.1423
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No