Information card for entry 7125838

Structure parameters

• Formula: C34 H31 N O2
• Calculated formula: C34 H31 N O2
• Title of publication: Access to the most sterically crowded anilines via non-catalysed C-C coupling reactions.
• Authors of publication: Vrána, Jan; Samsonov, Maksim A.; Němec, Vlastimil; RůŽička, Aleš
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 16
• Pages of publication: 2487 - 2490
• a: 8.7448 ± 0.0008 Å
• b: 12.2039 ± 0.0012 Å
• c: 13.7109 ± 0.0012 Å
• α: 71.125 ± 0.004°
• β: 73.114 ± 0.004°
• γ: 76.737 ± 0.004°
• Cell volume: 1309.9 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0941
• Residual factor for significantly intense reflections: 0.0763
• Weighted residual factors for significantly intense reflections: 0.2389
• Weighted residual factors for all reflections included in the refinement: 0.2467
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No