Information card for entry 7237529

Structure parameters

• Formula: C57 H45.71 Cl1.29 N3 O4.36
• Calculated formula: C57 H45.716 Cl1.284 N3 O4.358
• Title of publication: Robust luminescent small molecules with aggregation-induced delayed fluorescence for efficient solution-processed OLEDs
• Authors of publication: Huang, Jian; Xu, Zeng; Cai, Zheyi; Guo, Jingjing; Guo, Jiali; Shen, Pingchuan; Wang, Zhiming; Zhao, Zujin; Ma, Dongge; Tang, Ben Zhong
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 2
• Pages of publication: 330
• a: 7.175 ± 0.0006 Å
• b: 18.3221 ± 0.0016 Å
• c: 33.824 ± 0.003 Å
• α: 90°
• β: 91.414 ± 0.002°
• γ: 90°
• Cell volume: 4445.2 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.154
• Residual factor for significantly intense reflections: 0.0759
• Weighted residual factors for significantly intense reflections: 0.1265
• Weighted residual factors for all reflections included in the refinement: 0.1488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No