Information card for entry 7125383

Structure parameters

• Formula: C28 H32 Cl4 Fe2 N8 O
• Calculated formula: C28 H32 Cl4 Fe2 N8 O
• Title of publication: An earth-abundant system for light-driven CO₂ reduction to CO using a pyridinophane iron catalyst.
• Authors of publication: Sakaguchi, Yuto; Call, Arnau; Cibian, Mihaela; Yamauchi, Kosei; Sakai, Ken
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2019
• Journal volume: 55
• Journal issue: 59
• Pages of publication: 8552 - 8555
• a: 9.1131 ± 0.0016 Å
• b: 11.477 ± 0.002 Å
• c: 18.784 ± 0.003 Å
• α: 98.812 ± 0.002°
• β: 92.127 ± 0.002°
• γ: 91.893 ± 0.002°
• Cell volume: 1938.6 ± 0.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0715
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1574
• Weighted residual factors for all reflections included in the refinement: 0.1645
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No