Information card for entry 1552408

Structure parameters

• Formula: C142 H106 Mg2 N4
• Calculated formula: C142 H106 Mg2 N4
• Title of publication: Hydrocarbon-soluble, hexaanionic fulleride complexes of magnesium
• Authors of publication: Lawrence, Samuel R.; Ohlin, C. André; Cordes, David Bradford; Slawin, Alexandra; Stasch, Andreas
• Journal of publication: Chemical Science
• Year of publication: 2019
• a: 14.5468 ± 0.0007 Å
• b: 14.6808 ± 0.0004 Å
• c: 24.376 ± 0.0007 Å
• α: 80.2 ± 0.002°
• β: 79.333 ± 0.003°
• γ: 88.952 ± 0.003°
• Cell volume: 5040.6 ± 0.3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.1132
• Residual factor for significantly intense reflections: 0.1014
• Weighted residual factors for significantly intense reflections: 0.328
• Weighted residual factors for all reflections included in the refinement: 0.3364
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No