Information card for entry 1576783

Structure parameters

• Chemical name: C62H66BF24FeNO2P2
• Formula: C62 H66 B F24 Fe N O2 P2
• Calculated formula: C62 H66 B F24 Fe N O2 P2
• 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: 42.29 ± 0.005 Å
• b: 14.2781 ± 0.0017 Å
• c: 25.93 ± 0.003 Å
• α: 90°
• β: 123.835 ± 0.004°
• γ: 90°
• Cell volume: 13005 ± 3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1436
• Residual factor for significantly intense reflections: 0.0928
• Weighted residual factors for significantly intense reflections: 0.2136
• Weighted residual factors for all reflections included in the refinement: 0.2445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No