Information card for entry 7702234

Structure parameters

• Formula: C78 H86 Co4 N6 O14
• Calculated formula: C78 H86 Co4 N6 O14
• Title of publication: Reactions of dicobalt octacarbonyl with dinucleating and mononucleating bis(imino)pyridine ligands.
• Authors of publication: Hollingsworth, Ryan L.; Beattie, Jeffrey W.; Grass, Amanda; Martin, Philip D.; Groysman, Stanislav; Lord, Richard L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 43
• Pages of publication: 15353 - 15363
• a: 20.268 ± 0.002 Å
• b: 18.2285 ± 0.0017 Å
• c: 21.168 ± 0.002 Å
• α: 90°
• β: 90.683 ± 0.006°
• γ: 90°
• Cell volume: 7820.1 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.1 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.2285
• Residual factor for significantly intense reflections: 0.136
• Weighted residual factors for significantly intense reflections: 0.3441
• Weighted residual factors for all reflections included in the refinement: 0.3922
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2155
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No