Information card for entry 7130030

Structure parameters

• Formula: C2.55 H2.06 Cd0.12 N0.61 O1.33
• Calculated formula: C2.54545 H2.06061 Cd0.121212 N0.606061 O1.33333
• Title of publication: Chelation-activated ultralong room-temperature phosphorescence and thermo-/excitation-dependent persistent luminescence
• Authors of publication: Siqin, Wu; Zhou, Bo; Fang, Xiaoyu; Yan, Dongpeng
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 11.4639 ± 0.0004 Å
• b: 14.559 ± 0.0004 Å
• c: 14.1126 ± 0.0004 Å
• α: 90°
• β: 100.388 ± 0.003°
• γ: 90°
• Cell volume: 2316.83 ± 0.12 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0573
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.1479
• Weighted residual factors for all reflections included in the refinement: 0.1506
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No