Information card for entry 7701307

Structure parameters

• Formula: C41 H47 Co N2
• Calculated formula: C41 H47 Co N2
• Title of publication: Direct synthesis of an anionic 13-vertex closo-cobaltacarborane cluster.
• Authors of publication: Maier, Thomas M.; Coburger, Peter; van Leest, Nicolaas P.; Hey-Hawkins, Evamarie; Wolf, Robert
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 42
• Pages of publication: 15772 - 15777
• a: 8.1878 ± 0.0009 Å
• b: 10.6068 ± 0.0009 Å
• c: 19.8411 ± 0.0013 Å
• α: 102.644 ± 0.006°
• β: 95.457 ± 0.007°
• γ: 97.86 ± 0.008°
• Cell volume: 1651.6 ± 0.3 ų
• Cell temperature: 123 ± 1 K
• Ambient diffraction temperature: 123 ± 1 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.079
• Residual factor for significantly intense reflections: 0.0683
• Weighted residual factors for significantly intense reflections: 0.1661
• Weighted residual factors for all reflections included in the refinement: 0.1728
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No