Information card for entry 7106042

Structure parameters

• Formula: C32 H42 Mg N12
• Calculated formula: C32 H42 Mg0.5001 N12
• Title of publication: Experimental charge density distribution of non-coordinating sp3 carbanions in [Mg{(pz*)3C}2]
• Authors of publication: Daniel Kratzert; Dirk Leusser; Daniel Stern; Jens Meyer; Frank Breher; Dietmar Stalke
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 2931
• a: 10.6329 ± 0.001 Å
• b: 10.6329 ± 0.001 Å
• c: 24.569 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2405.6 ± 0.4 ų
• Cell temperature: 15 ± 2 K
• Ambient diffraction temperature: 15 ± 2 K
• Number of distinct elements: 4
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.019
• Residual factor for significantly intense reflections: 0.016
• Weighted residual factors for all reflections included in the refinement: 0.034
• RFsqd: 0.021
• Goodness-of-fit parameter for all reflections included in the refinement: 2.476
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No