Information card for entry 7042363

Structure parameters

• Formula: C76 H76 B Co F4 N14
• Calculated formula: C76 H76 B Co F4 N14
• Title of publication: Tuneable reversible redox of cobalt(iii) carbazole complexes.
• Authors of publication: Bennington, Michael S.; Feltham, Humphrey L. C.; Buxton, Zoë J; White, Nicholas G.; Brooker, Sally
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 14
• Pages of publication: 4696 - 4710
• a: 16.32274 ± 0.00018 Å
• b: 16.32274 ± 0.00018 Å
• c: 13.22212 ± 0.00018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3522.79 ± 0.07 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n :2
• Hall space group symbol: -P 4a
• Residual factor for all reflections: 0.0673
• Residual factor for significantly intense reflections: 0.0619
• Weighted residual factors for all reflections: 0.1809
• Weighted residual factors for significantly intense reflections: 0.1725
• Weighted residual factors for all reflections included in the refinement: 0.1809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0276
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No