Information card for entry 7110967

Structure parameters

• Formula: C124 H148 Mg4 O10
• Calculated formula: C124 H148 Mg4 O10
• Title of publication: Synthesis and structural characterisation of a magnesium bisenolate: a tetrameric (Mg2O2)2 chain terminated by solvating ketone
• Authors of publication: Allan, John F.; Henderson, Kenneth W.; Kennedy, Alan R.; Teat, Simon J.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 12
• Pages of publication: 1059
• a: 11.8142 ± 0.0007 Å
• b: 11.8617 ± 0.0007 Å
• c: 20.5469 ± 0.0013 Å
• α: 74.844 ± 0.002°
• β: 84.437 ± 0.002°
• γ: 83.078 ± 0.002°
• Cell volume: 2752.5 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.096
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for significantly intense reflections: 0.174
• Weighted residual factors for all reflections included in the refinement: 0.1823
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.6884 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No