Information card for entry 7701306

Structure parameters

• Formula: C56 H58 B10 Co N2 P2
• Calculated formula: C56 H58 B10 Co N2 P2
• 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: 11.2578 ± 0.0002 Å
• b: 24.1038 ± 0.0004 Å
• c: 19.6169 ± 0.0003 Å
• α: 90°
• β: 96.95 ± 0.002°
• γ: 90°
• Cell volume: 5284.04 ± 0.15 ų
• Cell temperature: 123 ± 1 K
• Ambient diffraction temperature: 123 ± 1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0524
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.1189
• Weighted residual factors for all reflections included in the refinement: 0.123
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No