Information card for entry 7110895

Structure parameters

• Formula: C47 H18 B3 Cl2 F25 Ni2 O3
• Calculated formula: C47 H18 B3 Cl2 F25 Ni2 O3
• Title of publication: Weakly-coordinating anions stabilise the unprecedented monovalent and divalent η-benzene nickel cations [(η-C5H5)Ni(η-C6H6)Ni(η-C5H5)]2+ and [Ni(η-C6H6)2]2+
• Authors of publication: Priego, José L.; Doerrer, Linda H.; Rees, Leigh H.; Green, Malcolm. L. H.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 9
• Pages of publication: 779
• a: 11.873 ± 0.007 Å
• b: 13.526 ± 0.008 Å
• c: 16.304 ± 0.008 Å
• α: 73.658 ± 0.006°
• β: 75.969 ± 0.006°
• γ: 71.607 ± 0.006°
• Cell volume: 2350 ± 2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for all reflections included in the refinement: 0.0572
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0715
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No