Information card for entry 7223248

Structure parameters

• Formula: C26 H16 N4 O8 Zn
• Calculated formula: C26 H16 N4 O8 Zn
• Title of publication: Removal and safe reuse of highly toxic allyl alcohol using a highly selective photo-sensitive metal‒organic framework
• Authors of publication: Gong, Le Le; Feng, Xue Feng; Luo, Feng; Yi, Xian Feng; Zheng, An Min
• Journal of publication: Green Chem.
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 7
• Pages of publication: 2047
• a: 19.13 ± 0.03 Å
• b: 26.34 ± 0.04 Å
• c: 11.628 ± 0.017 Å
• α: 90°
• β: 90.671 ± 0.018°
• γ: 90°
• Cell volume: 5859 ± 15 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1668
• Residual factor for significantly intense reflections: 0.1219
• Weighted residual factors for significantly intense reflections: 0.3075
• Weighted residual factors for all reflections included in the refinement: 0.3337
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No