Information card for entry 7230755

Structure parameters

• Formula: C26 H16 N6 O6 Zn
• Calculated formula: C26 H16 N6 O6 Zn
• 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: 10.748 ± 0.002 Å
• b: 12.175 ± 0.002 Å
• c: 19.15 ± 0.004 Å
• α: 90°
• β: 97.74 ± 0.03°
• γ: 90°
• Cell volume: 2483.1 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0424
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.0795
• Weighted residual factors for all reflections included in the refinement: 0.0847
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No