Information card for entry 7117147

Structure parameters

• Formula: C31 H30 Al Cr F24 O7
• Calculated formula: C31 H30 Al Cr F24 O7
• Title of publication: The long-sought seventeen-electron radical [(C6Me6)Cr(CO)3]+: isolation, crystal structure and substitution reaction
• Authors of publication: Wenqing Wang; Xingyong Wang; Zaichao Zhang; Ningning Yuan; Xinping Wang
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 8410
• a: 25.012 ± 0.003 Å
• b: 13.9336 ± 0.0015 Å
• c: 25.099 ± 0.003 Å
• α: 90°
• β: 111.913 ± 0.001°
• γ: 90°
• Cell volume: 8115.2 ± 1.6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1098
• Residual factor for significantly intense reflections: 0.0867
• Weighted residual factors for significantly intense reflections: 0.2292
• Weighted residual factors for all reflections included in the refinement: 0.2434
• Goodness-of-fit parameter for all reflections included in the refinement: 1.181
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No