Information card for entry 7702196

Structure parameters

• Common name: anticipated monometallic cobalt(II) complex
• Formula: C17 H22 B2 Br2 Co F8 N4 O3
• Calculated formula: C17 H22 B2 Br2 Co F8 N4 O3
• Title of publication: Substituents drive ligand rearrangements, giving dinuclear rather than mononuclear complexes, and tune Co^II/III redox potential.
• Authors of publication: Karabulut, Fabrice N. H.; Feltham, Humphrey L. C.; Brooker, Sally
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 34
• Pages of publication: 11749 - 11759
• a: 9.6911 ± 0.0004 Å
• b: 11.6204 ± 0.0004 Å
• c: 22.6509 ± 0.0007 Å
• α: 90°
• β: 93.838 ± 0.003°
• γ: 90°
• Cell volume: 2545.1 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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: 0.0578
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1374
• Weighted residual factors for all reflections included in the refinement: 0.1434
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No