Information card for entry 7218938

Structure parameters

• Formula: C42 H26
• Calculated formula: C42 H26
• SMILES: c12ccccc1cc1c(c2C(=C2c3ccccc3c3ccccc23)c2c3ccccc3cc3c2cccc3)cccc1
• Title of publication: Efficient Green-Red Piezofluorochromism of Bisanthracene-Modified Dibenzofulvene
• Authors of publication: Zhang, Guo-Feng; Aldred, Matthew; Chen, Ze-Qiang; Chen, Tao; Meng, Xiang-Gao; Zhu, Ming-Qiang
• Journal of publication: RSC Adv.
• Year of publication: 2014
• a: 17.948 ± 0.003 Å
• b: 7.2978 ± 0.0013 Å
• c: 21.108 ± 0.004 Å
• α: 90°
• β: 101.866 ± 0.003°
• γ: 90°
• Cell volume: 2705.7 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0931
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for significantly intense reflections: 0.1315
• Weighted residual factors for all reflections included in the refinement: 0.18
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No