Information card for entry 7058618

Structure parameters

• Formula: C41 H38 Cl12 Fe4 N6
• Calculated formula: C41 H38 Cl12 Fe4 N6
• Title of publication: The first example of an asymmetrical μ-oxo bridged dinuclear iron complex with a terpyridine ligand
• Authors of publication: Bocian, Aleksandra; Napierała, Sergiusz; Gorczyński, Adam; Kubicki, Maciej; Wałęsa-Chorab, Monika; Patroniak, Violetta
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 32
• Pages of publication: 12650
• a: 8.31307 ± 0.00009 Å
• b: 31.0196 ± 0.0003 Å
• c: 9.76421 ± 0.0001 Å
• α: 90°
• β: 96.5938 ± 0.001°
• γ: 90°
• Cell volume: 2501.22 ± 0.04 ų
• Cell temperature: 130 ± 1 K
• Ambient diffraction temperature: 130 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0947
• Residual factor for significantly intense reflections: 0.0854
• Weighted residual factors for significantly intense reflections: 0.2105
• Weighted residual factors for all reflections included in the refinement: 0.2202
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No