Information card for entry 7236970

Structure parameters

• Formula: C29 H21 N5 O
• Calculated formula: C29 H21 N5 O
• Title of publication: Prolonging the lifetime of ultralong organic phosphorescence through dihydrogen bonding
• Authors of publication: Gu, Long; Shi, Huifang; Miao, Chunyang; Wu, Qi; Cheng, Zhichao; Cai, Suzhi; Gu, Mingxing; Ma, Chaoqun; Yao, Wei; Gao, Yaru; An, Zhongfu; Huang, Wei
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 2
• Pages of publication: 226
• a: 7.661 ± 0.003 Å
• b: 10.946 ± 0.005 Å
• c: 14.26 ± 0.006 Å
• α: 72.721 ± 0.005°
• β: 84.178 ± 0.006°
• γ: 77.936 ± 0.005°
• Cell volume: 1115.6 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1318
• Residual factor for significantly intense reflections: 0.0999
• Weighted residual factors for significantly intense reflections: 0.2999
• Weighted residual factors for all reflections included in the refinement: 0.3365
• Goodness-of-fit parameter for all reflections included in the refinement: 1.204
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No