Information card for entry 7108436

Structure parameters

• Formula: C54 H50 Co O5 P
• Calculated formula: C54 H50 Co O5 P
• Title of publication: Diastereoselective synthesis of half-sandwich chiral-at-metal cobaltacycles by oxidative cyclisation
• Authors of publication: Jahangir Amin; Christopher J. Richards
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 10192
• a: 12.4703 ± 0.0006 Å
• b: 13.2242 ± 0.0007 Å
• c: 14.7781 ± 0.0007 Å
• α: 98.752 ± 0.002°
• β: 110.602 ± 0.003°
• γ: 97.307 ± 0.003°
• Cell volume: 2211.2 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1706
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.1295
• Weighted residual factors for all reflections included in the refinement: 0.1606
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No