Information card for entry 1553414

Structure parameters

• Common name: TPF
• Chemical name: 2,3,4,5-tetraphenylfuran
• Formula: C28 H20 O
• Calculated formula: C28 H20 O
• SMILES: o1c(c(c(c1c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: Tetraphenylfuran: aggregation-induced emission or aggregation-caused quenching?
• Authors of publication: Nie, Han; Hu, Kun; Cai, Yuanjing; Peng, Qian; Zhao, Zujin; Hu, Rongrong; Chen, Junwu; Su, Shi-Jian; Qin, Anjun; Tang, Ben Zhong
• Journal of publication: Materials Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 1
• Journal issue: 6
• Pages of publication: 1125
• a: 21.71 ± 0.007 Å
• b: 8.16 ± 0.0015 Å
• c: 24.855 ± 0.008 Å
• α: 90°
• β: 113.396 ± 0.019°
• γ: 90°
• Cell volume: 4041 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/c 1
• Hall space group symbol: -I 2yc
• Residual factor for all reflections: 0.0489
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.1012
• Weighted residual factors for all reflections included in the refinement: 0.1095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No