Information card for entry 7230754

Structure parameters

• Formula: C72 H48 N14 O34 Zn5
• Calculated formula: C72 H48 N14 O34 Zn5
• Title of publication: Three new Zn-based metal‒organic frameworks exhibiting selective fluorescence sensing and photocatalytic activity
• Authors of publication: Wang, Jun-Jie; Zhang, You-Juan; Chen, Yan; Si, Pan-Pan; Pan, Ya-Ya; Yang, Jie; Fan, Rui-Yang; Li, Zhao-Yang
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 27
• Pages of publication: 3877
• a: 12.931 ± 0.003 Å
• b: 27.071 ± 0.005 Å
• c: 13.699 ± 0.003 Å
• α: 90°
• β: 118.15 ± 0.03°
• γ: 90°
• Cell volume: 4228 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1529
• Residual factor for significantly intense reflections: 0.0661
• Weighted residual factors for significantly intense reflections: 0.1346
• Weighted residual factors for all reflections included in the refinement: 0.1619
• Goodness-of-fit parameter for all reflections included in the refinement: 0.872
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No