Information card for entry 2231187

Structure parameters

• Chemical name: Triethylammonium hexa-μ~2~-acetato-κ^12^<i>O</i>:<i>O</i>'-diacetato- κ^2^<i>O</i>-aqua-μ~3~-oxido-triferrate(III) toluene monosolvate
• Formula: C29 H50 Fe3 N O18
• Calculated formula: C29 H50 Fe3 N O18
• Title of publication: Triethylammonium hexa-μ~2~-acetato-κ^12^<i>O</i>:<i>O</i>'-diacetato-κ^2^<i>O</i>-aqua-μ~3~-oxido-triferrate(III) toluene monosolvate
• Authors of publication: Burgoyne, Andrew R.; Meijboom, Reinout; Muller, Alfred; Omondi, Bernard O.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: m1092 - m1093
• a: 22.437 ± 0.0011 Å
• b: 11.106 ± 0.0005 Å
• c: 16.572 ± 0.0009 Å
• α: 90°
• β: 112.904 ± 0.001°
• γ: 90°
• Cell volume: 3803.9 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0474
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.0947
• Weighted residual factors for all reflections included in the refinement: 0.0985
• 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: Yes