Information card for entry 7111240

Structure parameters

• Formula: C144 H208.43 Cl12 Co12 N12 O59.22
• Calculated formula: C144 H204 Cl12 Co12 N12 O57
• Title of publication: Synthetic and magnetic studies of a dodecanuclear cobalt wheel
• Authors of publication: Brechin, Euan K.; Cador, Olivier; Caneschi, Andrea; Cadiou, Cyril; Harris, Steven G.; Parsons, Simon; Vonci, Michele; Winpenny, Richard E. P.
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 17
• Pages of publication: 1860
• a: 23.094 ± 0.003 Å
• b: 23.094 ± 0.003 Å
• c: 64.051 ± 0.018 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 29584 ± 10 ų
• Cell temperature: 220 ± 0.2 K
• Ambient diffraction temperature: 220 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.1659
• Residual factor for significantly intense reflections: 0.0895
• Weighted residual factors for all reflections: 0.2478
• Weighted residual factors for significantly intense reflections: 0.2018
• Goodness-of-fit parameter for all reflections: 0.993
• Goodness-of-fit parameter for significantly intense reflections: 1.188
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No