Information card for entry 7015090

Structure parameters

• Formula: C12 H47.88 Br1.96 Co28.18 K O69.65
• Calculated formula: C12 H43 Br1.953 Co28.18 K O69.6504
• Title of publication: Structure and magnetism of new hybrid cobalt hydroxide materials built from decorated brucite layers.
• Authors of publication: Keene, Tony D.; Light, Mark E.; Hursthouse, Michael B.; Price, Daniel J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 12
• Pages of publication: 2983 - 2994
• a: 13.814 ± 0.0002 Å
• b: 13.814 ± 0.0002 Å
• c: 19.9012 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3288.89 ± 0.08 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 159
• Hermann-Mauguin space group symbol: P 3 1 c
• Hall space group symbol: P 3 -2c
• Residual factor for all reflections: 0.042
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for significantly intense reflections: 0.099
• Weighted residual factors for all reflections included in the refinement: 0.1003
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No