Information card for entry 4127602

Structure parameters

• Formula: C40 H56 Mg N5
• Calculated formula: C40 H56 Mg N5
• Title of publication: Reductive Trimerization of CO to the Deltate Dianion Using Activated Magnesium(I) Compounds.
• Authors of publication: Yuvaraj, K.; Douair, Iskander; Paparo, Albert; Maron, Laurent; Jones, Cameron
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 22
• Pages of publication: 8764 - 8768
• a: 11.3076 ± 0.0002 Å
• b: 12.1875 ± 0.0003 Å
• c: 14.7195 ± 0.0003 Å
• α: 80.021 ± 0.002°
• β: 79.085 ± 0.002°
• γ: 78.468 ± 0.002°
• Cell volume: 1932.18 ± 0.07 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.081
• Residual factor for significantly intense reflections: 0.0751
• Weighted residual factors for significantly intense reflections: 0.2251
• Weighted residual factors for all reflections included in the refinement: 0.2324
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No