Information card for entry 1554005

Structure parameters

• Formula: C37 H24
• Calculated formula: C37 H24
• SMILES: C12(c3c(c4c1cc(cc4)c1ccccc1)ccc(c3)c1ccccc1)c1c(c3c2cccc3)cccc1
• Title of publication: Photochemical Degradation of Various Bridge-Substituted Fluorene-Based Materials.
• Authors of publication: Kobin, Björn; Behren, Sandra; Braun-Cula, Beatrice; Hecht, Stefan
• Journal of publication: The journal of physical chemistry. A
• Year of publication: 2016
• Journal volume: 120
• Journal issue: 28
• Pages of publication: 5474 - 5480
• a: 13.7193 ± 0.0003 Å
• b: 16.2571 ± 0.0004 Å
• c: 11.2574 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2510.81 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0411
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for significantly intense reflections: 0.1109
• Weighted residual factors for all reflections included in the refinement: 0.1127
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No