Information card for entry 1576308

Structure parameters

• Formula: C40 H28
• Calculated formula: C40 H28
• Title of publication: Pressure-Induced Emission Enhancement through a Synergistic Effect between Suppression of Excimer Formation and Activation of Aggregation-Induced Emission
• Authors of publication: Yang, Xinqi; Dai, Yuxiang; Zhang, Xiaoxiang; Yang, Daojie; Guo, Ru; Yan, Haile; Zhang, Lili; Wang, Kai; Liu, Haichao; Yang, Bing
• Journal of publication: Chemical Science
• Year of publication: 2025
• a: 16.161 ± 0.004 Å
• b: 10.122 ± 0.003 Å
• c: 17.127 ± 0.005 Å
• α: 90°
• β: 92.691 ± 0.009°
• γ: 90°
• Cell volume: 2798.6 ± 1.4 ų
• Cell temperature: 98 K
• Ambient diffraction temperature: 98 K
• Number of distinct elements: 2
• 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: 0.1368
• Residual factor for significantly intense reflections: 0.0736
• Weighted residual factors for significantly intense reflections: 0.1898
• Weighted residual factors for all reflections included in the refinement: 0.2662
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No