Information card for entry 1573618

Structure parameters

• Chemical name: 4,5-di(anthracen-9-yl)-9,9-dimethyl-9H-xanthene
• Formula: C43 H30 O
• Calculated formula: C43 H30 O
• SMILES: O1c2c(c3c4c(cc5c3cccc5)cccc4)cccc2C(c2c1c(c1c3c(cc4c1cccc4)cccc3)ccc2)(C)C
• Title of publication: A comparative investigation on excimer fluorescence toward its bright future.
• Authors of publication: Wang, Shiyin; Liu, Haichao; Zhao, Shuaiqiang; Wu, Qiaolin; Yang, Zhiqiang; Yang, Daojie; Lv, Yingbo; Su, Qing; Zhang, Shi-Tong; Yang, Bing
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 7
• Pages of publication: 3275 - 3284
• a: 9.1255 ± 0.0005 Å
• b: 17.9972 ± 0.0011 Å
• c: 18.3091 ± 0.0011 Å
• α: 90.153 ± 0.002°
• β: 90.817 ± 0.002°
• γ: 94.909 ± 0.002°
• Cell volume: 2995.6 ± 0.3 ų
• Cell temperature: 302 K
• Ambient diffraction temperature: 302 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0709
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.1282
• Weighted residual factors for all reflections included in the refinement: 0.152
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No