Information card for entry 7712155

Structure parameters

• Formula: C24 H32.4 Cl4 Fe3 N3 O8.2
• Calculated formula: C24 H32 Cl4 Fe3 N3 O8.2
• Title of publication: Synthesis and structural, magnetic and spectroscopic characterization of iron(III) complexes with <i>in situ</i> formed ligands from methyl-2-pyridyl ketone transformations.
• Authors of publication: Tzani, Sofia; Pissas, Michael; Psycharis, Vassilis; Pantazis, Dimitrios A.; Sanakis, Yiannis; Raptopoulou, Catherine P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 6
• Pages of publication: 1582 - 1594
• a: 11.0768 ± 0.0002 Å
• b: 12.964 ± 0.0002 Å
• c: 13.9148 ± 0.0003 Å
• α: 112.906 ± 0.001°
• β: 101.93 ± 0.001°
• γ: 105.515 ± 0.001°
• Cell volume: 1661.22 ± 0.06 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 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: 0.0911
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.1115
• Weighted residual factors for all reflections included in the refinement: 0.1591
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No