Information card for entry 7056652

Structure parameters

• Formula: C124 H168
• Calculated formula: C124 H168
• Title of publication: Synthesis and Ring Opening Reaction of Octaoctyl Substituted [2.2.2.2](2,7)-Fluorenophanetetraene by Photooxidation
• Authors of publication: Yu, Chin-Yang; Chen, Yu-Chi; Wang, Chao-Chi
• Journal of publication: New J. Chem.
• Year of publication: 2017
• a: 26.301 ± 0.002 Å
• b: 18.6381 ± 0.0015 Å
• c: 22.7995 ± 0.0016 Å
• α: 90°
• β: 107.972 ± 0.005°
• γ: 90°
• Cell volume: 10631 ± 1.4 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.318
• Residual factor for significantly intense reflections: 0.0975
• Weighted residual factors for significantly intense reflections: 0.2346
• Weighted residual factors for all reflections included in the refinement: 0.3416
• Goodness-of-fit parameter for all reflections included in the refinement: 0.902
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No