Information card for entry 7027721

Structure parameters

• Formula: C23.5 H7 B Cl Co0.5 F15 O
• Calculated formula: C23.5 H7 B Cl Co0.5 F15 O
• Title of publication: Oxidation of [M(η-C5H5)2], M = Cr, Fe or Co, by the new Brønsted acid H2O·B(C6F5)3 yielding the salts [M(η-C5H5)2]+A−, where A− = [(C6F5)3B(μ-OH)B(C6F5)3]− or [(C6F5)3BOH · · · H2OB(C6F5)3]− †
• Authors of publication: Doerrer, Linda H.; Green, Malcolm L. H.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 24
• Pages of publication: 4325
• a: 14.253 ± 0.0009 Å
• b: 24.178 ± 0.0009 Å
• c: 14.135 ± 0.0008 Å
• α: 90°
• β: 90 ± 0.003°
• γ: 90°
• Cell volume: 4871 ± 0.5 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.0792
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8863
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No