Information card for entry 7116921

Structure parameters

• Formula: C52 H41 O
• Calculated formula: C51.994 H41 O
• Title of publication: 9,9'-Anthryl-anthroxyl radicals: strategic stabilization of highly reactive phenoxyl radicals
• Authors of publication: Tatsuya Aotake; Mitsuharu Suzuki; Naoki Aratani; Junpei Yuasa; Daiki Kuzuhara; Hironobu Hayashi; Haruyuki Nakano; Tsuyoshi Kawai; Jishan Wu; Hiroko Yamada
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 6734
• a: 10.6594 ± 0.0003 Å
• b: 21.7535 ± 0.0007 Å
• c: 16.0991 ± 0.0004 Å
• α: 90°
• β: 100.123 ± 0.001°
• γ: 90°
• Cell volume: 3674.93 ± 0.18 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0824
• Residual factor for significantly intense reflections: 0.0646
• Weighted residual factors for significantly intense reflections: 0.1708
• Weighted residual factors for all reflections included in the refinement: 0.1832
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No