Information card for entry 4341259

Structure parameters

• Formula: C50 H49 Fe4 K3 N4 O30
• Calculated formula: C50 H49 Fe4 K3 N4 O30
• Title of publication: Synthesis, Characterization, and Spectroscopic Investigation of New Iron(III) and Copper(II) Complexes of a Carboxylate Rich Ligand and Their Interaction with Carbohydrates in Aqueous Solution.
• Authors of publication: Stewart, Christopher D.; Arman, Hadi; Bawazir, Huda; Musie, Ghezai T.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 20
• Pages of publication: 10974 - 10988
• a: 11.2843 ± 0.0008 Å
• b: 25.6605 ± 0.0018 Å
• c: 11.7228 ± 0.0008 Å
• α: 90°
• β: 118.009 ± 0.009°
• γ: 90°
• Cell volume: 2996.9 ± 0.4 ų
• Cell temperature: 98 ± 2 K
• Ambient diffraction temperature: 98 ± 2 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0771
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.133
• Weighted residual factors for all reflections included in the refinement: 0.1413
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No