Information card for entry 7244484

Structure parameters

• Formula: C26 H29 N O3
• Calculated formula: C26 H29 N O3
• Title of publication: Sustainable electrochemical dehydrogenative C(sp3)–H mono/di-alkylations
• Authors of publication: He, Jin-Yu; Qian, Wei-Feng; Wang, Yan-Zhao; Yao, Chaochao; Wang, Nana; Liu, Huilin; Zhong, Bing; Zhu, Cuiju; Xu, Hao
• Journal of publication: Green Chemistry
• Year of publication: 2022
• Journal volume: 24
• Journal issue: 6
• Pages of publication: 2483 - 2491
• a: 8.0026 ± 0.0011 Å
• b: 15.666 ± 0.002 Å
• c: 8.8626 ± 0.0012 Å
• α: 90°
• β: 93.268 ± 0.003°
• γ: 90°
• Cell volume: 1109.3 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1044
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.1114
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No