Information card for entry 7110332

Structure parameters

• Formula: C38 H28
• Calculated formula: C38 H28
• SMILES: c1ccccc1c1ccccc1/C(c1ccccc1)=C(/c1ccccc1)c1ccccc1c1ccccc1
• Title of publication: Stereoselective synthesis of folded luminogens with arene-arene stacking interactions and aggregation-enhanced emission
• Authors of publication: Zujin Zhao; Bairong He; Han Nie; Bin Chen; Ping Lu; Anjun Qin; Ben Zhong Tang
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 1131
• a: 12.3653 ± 0.0009 Å
• b: 22.7961 ± 0.0012 Å
• c: 19.7772 ± 0.0014 Å
• α: 90°
• β: 98.854 ± 0.007°
• γ: 90°
• Cell volume: 5508.4 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1892
• Residual factor for significantly intense reflections: 0.0669
• Weighted residual factors for significantly intense reflections: 0.1142
• Weighted residual factors for all reflections included in the refinement: 0.1601
• Goodness-of-fit parameter for all reflections included in the refinement: 0.953
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No