Information card for entry 4003457

Structure parameters

• Formula: C29 H25 Cd N7 O5
• Calculated formula: C29 H25 Cd N7 O5
• Title of publication: Breathing-Ignited Long Persistent Luminescence in a Resilient Metal‒Organic Framework
• Authors of publication: Wang, Zheng; Zhu, Cheng-Yi; Wei, Zhang-Wen; Fan, Ya-Nan; Pan, Mei
• Journal of publication: Chemistry of Materials
• Year of publication: 2020
• a: 12.384 ± 0.0003 Å
• b: 17.0244 ± 0.0003 Å
• c: 13.5782 ± 0.0003 Å
• α: 90°
• β: 109.56 ± 0.002°
• γ: 90°
• Cell volume: 2697.49 ± 0.11 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 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: 0.0597
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1501
• Weighted residual factors for all reflections included in the refinement: 0.1537
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No