Information card for entry 1571491

Structure parameters

• Formula: C17 H18 O2
• Calculated formula: C17 H18 O2
• Title of publication: Enantioconvergent synthesis of chiral fluorenols from racemic secondary alcohols <i>via</i> Pd(ii)/chiral norbornene cooperative catalysis.
• Authors of publication: Ding, Bo; Xue, Qilin; Wei, Han; Chen, Jiangwei; Liu, Ze-Shui; Cheng, Hong-Gang; Cong, Hengjiang; Tang, Jianting; Zhou, Qianghui
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 21
• Pages of publication: 7975 - 7981
• a: 12.2029 ± 0.0001 Å
• b: 12.207 ± 0.0001 Å
• c: 20.231 ± 0.0002 Å
• α: 106.041 ± 0.001°
• β: 106.066 ± 0.001°
• γ: 90.658 ± 0.001°
• Cell volume: 2770.52 ± 0.05 ų
• Cell temperature: 296.88 ± 0.15 K
• Ambient diffraction temperature: 296.88 ± 0.15 K
• Number of distinct elements: 3
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0329
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0885
• Weighted residual factors for all reflections included in the refinement: 0.089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No