Information card for entry 1569538

Structure parameters

• Formula: C30 H22 N2 O
• Calculated formula: C30 H22 N2 O
• Title of publication: Rhodium-catalyzed annulative approach to N-N axially chiral biaryls <i>via</i> C-H activation and dynamic kinetic transformation.
• Authors of publication: Zhu, Xiaohan; Wu, Hongli; Wang, Yishou; Huang, Genping; Wang, Fen; Li, Xingwei
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 32
• Pages of publication: 8564 - 8569
• a: 9.5313 ± 0.0003 Å
• b: 14.4824 ± 0.0005 Å
• c: 16.6299 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2295.53 ± 0.13 ų
• Cell temperature: 180 K
• Ambient diffraction temperature: 180 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0301
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0732
• Weighted residual factors for all reflections included in the refinement: 0.0747
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No