Information card for entry 7206055

Structure parameters

• Formula: C38 H36 O4
• Calculated formula: C38 H36 O4
• SMILES: c1cccc2c1C1(C3c4ccccc4C(C2c2ccccc12)(C(=O)OC(C)(C)C)c1ccccc31)C(=O)OC(C)(C)C
• Title of publication: Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives
• Authors of publication: Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2011
• Journal volume: 21
• Journal issue: 17
• Pages of publication: 6258
• a: 9.1605 ± 0.0002 Å
• b: 9.6923 ± 0.0002 Å
• c: 10.218 ± 0.0003 Å
• α: 67.1901 ± 0.0003°
• β: 85.3952 ± 0.0004°
• γ: 62.2311 ± 0.0003°
• Cell volume: 734.34 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0467
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.111
• Weighted residual factors for all reflections included in the refinement: 0.1155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No