Information card for entry 7119173

Structure parameters

• Formula: C64 H60 F3 N12 O52 P W12 Zn2
• Calculated formula: C64 H60 F3 N12 O52 P W12 Zn2
• Title of publication: Exceptional photosensitivity of a polyoxometalate-based charge-transfer hybrid material
• Authors of publication: Jian-Zhen Liao; Chen Wu; Xiao-Yuan Wu; Shui-Quan Deng; Can-Zhong Lu
• Journal of publication: Chem.Commun.
• Year of publication: 2016
• Journal volume: 52
• Pages of publication: 7394
• a: 19.5965 ± 0.0003 Å
• b: 19.5965 ± 0.0003 Å
• c: 16.078 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6174.32 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n :2
• Hall space group symbol: -P 4a
• Residual factor for all reflections: 0.0442
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0727
• Weighted residual factors for all reflections included in the refinement: 0.0765
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No