Information card for entry 1566539

Structure parameters

• Formula: C37 H33 N
• Calculated formula: C37 H33 N
• Title of publication: α-Branched Amines through Radical Coupling with 2-Azaallyl Anions, Redox Active Esters and Alkenes
• Authors of publication: Duan, Shengzu; Zi, Yujin; Wang, Lingling; Cong, Jielun; Chen, Wen; Li, Minyan; Zhang, Hongbin; Yang, Xiaodong; Walsh, Patrick
• Journal of publication: Chemical Science
• Year of publication: 2022
• a: 35.402 ± 0.005 Å
• b: 9.1778 ± 0.0013 Å
• c: 17.961 ± 0.003 Å
• α: 90°
• β: 110.844 ± 0.006°
• γ: 90°
• Cell volume: 5453.8 ± 1.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.073
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1647
• Weighted residual factors for all reflections included in the refinement: 0.179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No