Information card for entry 7116715

Structure parameters

• Formula: C24 H18
• Calculated formula: C24 H18
• SMILES: c1(cc(cc(c1)c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: Influence of the number and substitution position of phenyl groups on the aggregation-enhanced emission of benzene-cored luminogens
• Authors of publication: Lingzhi Li; Ming Chen; Haoke Zhang; Han Nie; Jing Zhi Sun; Anjun Qin; Ben Zhong Tang
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 4830
• a: 7.4869 ± 0.0001 Å
• b: 19.718 ± 0.0003 Å
• c: 11.2222 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1656.7 ± 0.04 ų
• Cell temperature: 173 ± 0.14 K
• Ambient diffraction temperature: 173 ± 0.14 K
• Number of distinct elements: 2
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0288
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0726
• Weighted residual factors for all reflections included in the refinement: 0.073
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No