Information card for entry 2104634

Structure parameters

• Formula: C28 H10 Co4 O12
• Calculated formula: C28 H10 Co4 O12
• Title of publication: Experimental and theoretical charge-density study of a tetranuclear cobalt carbonyl complex
• Authors of publication: Overgaard, Jacob; Platts, Jamie A.; Iversen, Bo B.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: 715 - 723
• a: 8.8195 ± 0.0003 Å
• b: 17.5085 ± 0.0005 Å
• c: 18.308 ± 0.0005 Å
• α: 90°
• β: 90.444 ± 0.001°
• γ: 90°
• Cell volume: 2826.97 ± 0.15 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.021
• Residual factor for significantly intense reflections: 0.016
• Weighted residual factors for all reflections included in the refinement: 0.021
• Goodness-of-fit parameter for all reflections included in the refinement: 1.53
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No