Information card for entry 4518189

Structure parameters

• Formula: C28 H12 F8
• Calculated formula: C28 H12 F8
• SMILES: c1(c(c(c(c2c1c(c(c(c2F)F)F)F)F)F)F)F.c1cccc2c1cc1cc3ccccc3cc1c2
• Title of publication: Green Grinding-Coassembly Engineering toward Intrinsically Luminescent Tetracene in Cocrystals.
• Authors of publication: Huang, Yinjuan; Gong, Qiuyu; Ge, Jing; Tang, Pengpeng; Yu, Fei; Xiao, Lian; Wang, Zongrui; Sun, Handong; Yu, Jing; Li, Dong-Sheng; Xiong, Qihua; Zhang, Qichun
• Journal of publication: ACS nano
• Year of publication: 2020
• a: 6.5484 ± 0.0006 Å
• b: 7.2693 ± 0.0006 Å
• c: 21.261 ± 0.002 Å
• α: 85.041 ± 0.003°
• β: 84.946 ± 0.003°
• γ: 89.943 ± 0.003°
• Cell volume: 1004.34 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.152
• Residual factor for significantly intense reflections: 0.0704
• Weighted residual factors for significantly intense reflections: 0.1345
• Weighted residual factors for all reflections included in the refinement: 0.1754
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No