Information card for entry 7027719

Structure parameters

• Formula: C23.5 H7 B Cl Cr0.5 F15 O
• Calculated formula: C23.5 H7 B Cl Cr0.5 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: 14.231 ± 0.003 Å
• b: 24.002 ± 0.005 Å
• c: 14.202 ± 0.003 Å
• α: 90°
• β: 90.63 ± 0.03°
• γ: 90°
• Cell volume: 4850.7 ± 1.8 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 0 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: 0.0949
• Weighted residual factors for all reflections included in the refinement: 0.0601
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9257
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No