Information card for entry 7009994

Structure parameters

• Formula: C119 H76 Cl26 Co13 N20 O30
• Calculated formula: C119 H76 Cl26 Co13 N20 O30
• Title of publication: Structural studies of heptanuclear cobalt complexes and larger oligomers based on heptanuclear fragments
• Authors of publication: Brechin, Euan K.; Graham, Alasdair; Parkin, Andrew; Parsons, Simon; Seddon, Annela M.; Winpenny, Richard E. P.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 19
• Pages of publication: 3242
• a: 17.165 ± 0.005 Å
• b: 18.243 ± 0.007 Å
• c: 26.613 ± 0.008 Å
• α: 90°
• β: 96.63 ± 0.04°
• γ: 90°
• Cell volume: 8278 ± 5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1881
• Residual factor for significantly intense reflections: 0.0926
• Weighted residual factors for all reflections: 0.2744
• Weighted residual factors for significantly intense reflections: 0.2013
• Goodness-of-fit parameter for all reflections: 1.021
• Goodness-of-fit parameter for significantly intense reflections: 1.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No