Information card for entry 7158745

Structure parameters

• Formula: C59 H73 Dy N6 O5
• Calculated formula: C59 H73 Dy N6 O5
• Title of publication: Visible light-induced selenylative spirocyclization of biaryl ynones toward the formation of selenated spiro[5.5]trienones.
• Authors of publication: Chen, Zhichao; Zheng, Xinran; Zhou, Shu-Feng; Cui, Xiuling
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2022
• Journal volume: 20
• Journal issue: 29
• Pages of publication: 5779 - 5783
• a: 17.124 ± 0.003 Å
• b: 14.155 ± 0.003 Å
• c: 22.873 ± 0.005 Å
• α: 90°
• β: 106.7 ± 0.03°
• γ: 90°
• Cell volume: 5310 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0704
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for significantly intense reflections: 0.1668
• Weighted residual factors for all reflections included in the refinement: 0.1683
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No