Information card for entry 1576777

Structure parameters

• Formula: C40 H78 Cl2 Fe2 P4
• Calculated formula: C40 H78 Cl2 Fe2 P4
• Title of publication: Metal–Metal vs Metal–Ligand Cooperation in Iron-Mediated Activation and Catalytic Reduction of Nitrous Oxide and Nitrobenzene
• Authors of publication: Jori, Nadir; Corona, Helena; Soto, Enrique; Fernandez, Israel; Campos, Jesús
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 8.5732 ± 0.0006 Å
• b: 14.6314 ± 0.0008 Å
• c: 17.7652 ± 0.0012 Å
• α: 90°
• β: 94.176 ± 0.003°
• γ: 90°
• Cell volume: 2222.5 ± 0.2 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 193 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: 0.0569
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0707
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No