Information card for entry 2023570

Structure parameters

• Chemical name: μ-Oxido-bis[(2-{[2-(3-methoxy-2-oxidobenzylideneamino)phenylimino]methyl}-6-methoxyphenolato)iron(III)] pentahydrate,
• Formula: C44 H46 Fe2 N4 O14
• Calculated formula: C44 H46 Fe2 N4 O14
• Title of publication: Structures of bimetallic FeIII–FeIII and trimetallic FeIII–K–FeIII complexes incorporating the deprotonated ligand N,N′-bis(2-hydroxy-3-methoxybenzylidene)-1,2-phenylenediamine
• Authors of publication: Thiam, Mariama; Diouf, Ngoné; Orton, James; Ndoye, Cheikh; Gueye, Amadou; Diouf, Ousmane; Thiam, Ibrahima Elhadji; Gaye, Mohamed; Coles, Simon
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2026
• Journal volume: 82
• Journal issue: 10
• a: 13.6001 ± 0.0004 Å
• b: 22.9342 ± 0.0005 Å
• c: 14.8502 ± 0.0005 Å
• α: 90°
• β: 113.199 ± 0.004°
• γ: 90°
• Cell volume: 4257.4 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0678
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1101
• Weighted residual factors for all reflections included in the refinement: 0.1188
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No