Information card for entry 4124180

Structure parameters

• Formula: C43 H59 N3 Ni O
• Calculated formula: C43 H59 N3 Ni O
• Title of publication: Highly Regioselective Indoline Synthesis under Nickel/Photoredox Dual Catalysis.
• Authors of publication: Tasker, Sarah Z.; Jamison, Timothy F.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2015
• Journal volume: 137
• Journal issue: 30
• Pages of publication: 9531 - 9534
• a: 11.6854 ± 0.0008 Å
• b: 13.0659 ± 0.0009 Å
• c: 14.9978 ± 0.001 Å
• α: 91.626 ± 0.0019°
• β: 109.319 ± 0.0017°
• γ: 114.956 ± 0.0018°
• Cell volume: 1921 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0356
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0864
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No