Information card for entry 7159026

Structure parameters

• Formula: C23 H29 B F N O3
• Calculated formula: C23 H29 B F N O3
• Title of publication: Enantio- and diastereoselective boron conjugate addition to α-alkyl α,β-unsaturated esters.
• Authors of publication: Li, Meng; Peng, Guang-Rui; Yang, Xuan; Ma, Zhen-Ning; Xie, Jian-Bo
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2022
• Journal volume: 21
• Journal issue: 1
• Pages of publication: 53 - 58
• a: 10.0208 ± 0.0005 Å
• b: 9.4096 ± 0.0005 Å
• c: 12.163 ± 0.0007 Å
• α: 90°
• β: 93.034 ± 0.002°
• γ: 90°
• Cell volume: 1145.26 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0609
• Residual factor for significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1624
• Weighted residual factors for all reflections included in the refinement: 0.1659
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No