Information card for entry 7046204

Structure parameters

• Formula: C98.96 H119.35 Fe4 N4 Na4 O10.27
• Calculated formula: C98.941 H119.261 Fe4 N4 Na4 O10.287
• Title of publication: Aminotroponiminates: ligand-centred, reversible redox events under oxidative conditions in sodium and bismuth complexes.
• Authors of publication: Hanft, Anna; Lichtenberg, Crispin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 31
• Pages of publication: 10578 - 10589
• a: 15.062 ± 0.003 Å
• b: 15.807 ± 0.003 Å
• c: 21.488 ± 0.004 Å
• α: 85.773 ± 0.006°
• β: 87.331 ± 0.006°
• γ: 62.126 ± 0.005°
• Cell volume: 4509.7 ± 1.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.094
• Residual factor for significantly intense reflections: 0.0548
• Weighted residual factors for significantly intense reflections: 0.1233
• Weighted residual factors for all reflections included in the refinement: 0.1435
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No