Information card for entry 7128825

Structure parameters

• Formula: C321 H412 Mg8 N16 O8
• Calculated formula: C264 H304 Mg8 N16 O8
• Title of publication: Reductive coupling of CO with magnesium anthracene complexes: formation of magnesium enediolates.
• Authors of publication: Yuvaraj, K.; Jones, Cameron
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 73
• Pages of publication: 9224 - 9227
• a: 33.1446 ± 0.0007 Å
• b: 18.8553 ± 0.0003 Å
• c: 23.5022 ± 0.0005 Å
• α: 90°
• β: 109.114 ± 0.002°
• γ: 90°
• Cell volume: 13878 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1262
• Residual factor for significantly intense reflections: 0.0756
• Weighted residual factors for significantly intense reflections: 0.162
• Weighted residual factors for all reflections included in the refinement: 0.1832
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No