Information card for entry 7159537

Structure parameters

• Formula: C35 H46 O2
• Calculated formula: C35 H46 O2
• Title of publication: DMSO-promoted direct δ-selective arylation of <i>p</i>-quinone methenylpiperidine bearinides to generate fuchsones under metal-free conditions by employing <i>p</i>-QMs themselves or substituted phenols as aryl sources.
• Authors of publication: Wang, Kunpeng; Li, Jingping; Zhang, Haoxiang; Chen, Yan; Li, Mengfan; Xu, Junju; Liao, Benren; Yi, Weiyin
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2023
• Journal volume: 21
• Journal issue: 35
• Pages of publication: 7151 - 7157
• a: 10.448 ± 0.009 Å
• b: 11.226 ± 0.009 Å
• c: 14.378 ± 0.012 Å
• α: 111.204 ± 0.017°
• β: 98.515 ± 0.018°
• γ: 95.224 ± 0.019°
• Cell volume: 1536 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2475
• Residual factor for significantly intense reflections: 0.0965
• Weighted residual factors for significantly intense reflections: 0.2324
• Weighted residual factors for all reflections included in the refinement: 0.2933
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No