Information card for entry 4125252

Structure parameters

• Formula: C72 H112 F2 Mg2 N4 O2
• Calculated formula: C71 H112 F2 Mg2 N4 O2
• Title of publication: Addition of Carbon-Fluorine Bonds to a Mg(I)-Mg(I) Bond: An Equivalent of Grignard Formation in Solution.
• Authors of publication: Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark R.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 39
• Pages of publication: 12763 - 12766
• a: 11.9516 ± 0.0005 Å
• b: 18.2934 ± 0.0007 Å
• c: 15.7645 ± 0.0006 Å
• α: 90°
• β: 99.934 ± 0.004°
• γ: 90°
• Cell volume: 3395 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: I 1 2/m 1
• Hall space group symbol: -I 2y
• Residual factor for all reflections: 0.0659
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.1066
• Weighted residual factors for all reflections included in the refinement: 0.1171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No