Information card for entry 7701305

Structure parameters

• Formula: C68 H88 B10 Co K N2 O6 P2
• Calculated formula: C68 H88 B10 Co K N2 O6 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: 13.9629 ± 0.0001 Å
• b: 13.727 ± 0.0002 Å
• c: 36.1365 ± 0.0004 Å
• α: 90°
• β: 95.597 ± 0.001°
• γ: 90°
• Cell volume: 6893.22 ± 0.14 ų
• Cell temperature: 123 ± 1 K
• Ambient diffraction temperature: 123 ± 1 K
• Number of distinct elements: 8
• 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: 0.0423
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0892
• Weighted residual factors for all reflections included in the refinement: 0.0926
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No