Information card for entry 8000524

Structure parameters

• Formula: C12 H9 N O
• Calculated formula: C12 H9 N O
• Title of publication: Influence of Guest/Host Morphology on Room Temperature Phosphorescence Properties of Pure Organic Doped Systems.
• Authors of publication: Liu, Xiaoqing; Pan, Yanyan; Lei, Yunxiang; Liu, Nannan; Dai, Wenbo; Liu, Miaochang; Cai, Zhengxu; Wu, Huayue; Huang, Xiaobo; Dong, Yuping
• Journal of publication: The journal of physical chemistry letters
• Year of publication: 2021
• Pages of publication: 7357 - 7364
• a: 20.556 ± 0.003 Å
• b: 7.6031 ± 0.0012 Å
• c: 6.1035 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 953.9 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0855
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.1737
• Weighted residual factors for all reflections included in the refinement: 0.1966
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No