Information card for entry 4341258

Structure parameters

• Formula: C127 H106 Fe8 K11 N8 O88.4
• Calculated formula: C127 H106 Fe8 K11 N8 O88.4
• 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: 11.4695 ± 0.0005 Å
• b: 16.8686 ± 0.0008 Å
• c: 22.9044 ± 0.0016 Å
• α: 95.884 ± 0.007°
• β: 103.814 ± 0.007°
• γ: 96.178 ± 0.007°
• Cell volume: 4240.4 ± 0.4 ų
• Cell temperature: 98 ± 2 K
• Ambient diffraction temperature: 98 ± 2 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: 0.0793
• Residual factor for significantly intense reflections: 0.0668
• Weighted residual factors for significantly intense reflections: 0.1481
• Weighted residual factors for all reflections included in the refinement: 0.154
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No