Information card for entry 1542938

Structure parameters

• Formula: C11 H6 N O5 Zn
• Calculated formula: C11 H6 N O5 Zn
• Title of publication: Long-afterglow metal‒organic frameworks: reversible guest-induced phosphorescence tunability
• Authors of publication: Yang, Xiaogang; Yan, Dongpeng
• Journal of publication: Chem. Sci.
• Year of publication: 2016
• Journal volume: 7
• Journal issue: 7
• Pages of publication: 4519
• a: 11.191 ± 0.006 Å
• b: 14.136 ± 0.008 Å
• c: 7.975 ± 0.005 Å
• α: 90°
• β: 106.894 ± 0.007°
• γ: 90°
• Cell volume: 1207.2 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0532
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.1497
• Weighted residual factors for all reflections included in the refinement: 0.1501
• Goodness-of-fit parameter for all reflections included in the refinement: 1.236
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No