Information card for entry 7134926

Structure parameters

• Formula: C38 H44 Fe N2 O4
• Calculated formula: C38 H44 Fe N2 O4
• Title of publication: Enantioselective C-H amination catalyzed by homoleptic iron salox complexes.
• Authors of publication: Stroek, Wowa; Rowlinson, Nathalie A. V.; Hudson, Luke A.; Albrecht, Martin
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 78
• Pages of publication: 15274 - 15277
• a: 12.2867 ± 0.00014 Å
• b: 6.39098 ± 0.00007 Å
• c: 20.0622 ± 0.0002 Å
• α: 90°
• β: 106.711 ± 0.0012°
• γ: 90°
• Cell volume: 1508.84 ± 0.03 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: I 1 2 1
• Hall space group symbol: I 2y
• Residual factor for all reflections: 0.0367
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0949
• Weighted residual factors for all reflections included in the refinement: 0.0954
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No