Information card for entry 1556210

Structure parameters

• Formula: C28 H22 N2 O
• Calculated formula: C28 H22 N2 O
• Title of publication: TEMPO-mediated aliphatic C-H oxidation with oximes and hydrazones.
• Authors of publication: Zhu, Xu; Wang, Yi-Feng; Ren, Wei; Zhang, Feng-Lian; Chiba, Shunsuke
• Journal of publication: Organic letters
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 13
• Pages of publication: 3214 - 3217
• a: 10.7757 ± 0.0006 Å
• b: 11.1883 ± 0.0007 Å
• c: 19.7287 ± 0.0012 Å
• α: 80.672 ± 0.003°
• β: 74.688 ± 0.003°
• γ: 68.604 ± 0.002°
• Cell volume: 2130.3 ± 0.2 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0818
• Residual factor for significantly intense reflections: 0.0519
• Weighted residual factors for significantly intense reflections: 0.1266
• Weighted residual factors for all reflections included in the refinement: 0.1547
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No