Information card for entry 7237263

Structure parameters

• Formula: C84 H54 O15
• Calculated formula: C84 H54 O15
• Title of publication: BINOL derivatives with aggression-induced emission
• Authors of publication: Shi, Lei; Li, Kun; Cui, Peng-Cheng; Li, Ling-Ling; Pan, Sheng-Lin; Li, Meng-Yang; Yu, Xiao-Qi
• Journal of publication: Journal of Materials Chemistry B
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 27
• Pages of publication: 4413
• a: 11.7124 ± 0.0004 Å
• b: 22.5365 ± 0.0007 Å
• c: 24.352 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6427.9 ± 0.3 ų
• Cell temperature: 293.7 ± 0.4 K
• Ambient diffraction temperature: 293.7 ± 0.4 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0615
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1374
• Weighted residual factors for all reflections included in the refinement: 0.1481
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No