Information card for entry 7108536

Structure parameters

• Formula: C52 H66 O2
• Calculated formula: C52 H66 O2
• SMILES: c1c2c(c3c(cccc3)c(c2ccc1)/C=C/c1ccc(OCCCCCCCCCCC)cc1)/C=C/c1ccc(OCCCCCCCCCCC)cc1
• Title of publication: Multifunctional organic fluorescent materials derived from 9,10-distyrylanthracene with alkoxyl endgroups of various lengths
• Authors of publication: Xiqi Zhang; Zhenguo Chi; Bingjia Xu; Long Jiang; Xie Zhou; Yi Zhang; Siwei Liu; Jiarui Xu
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 10895
• a: 5.7012 ± 0.0006 Å
• b: 7.8232 ± 0.0007 Å
• c: 23.669 ± 0.003 Å
• α: 92.182 ± 0.008°
• β: 96.212 ± 0.008°
• γ: 92.041 ± 0.008°
• Cell volume: 1047.9 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.05
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.1161
• Weighted residual factors for all reflections included in the refinement: 0.1239
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No