Information card for entry 7135086

Structure parameters

• Formula: C71 H133 Fe K N7 O11 Si4
• Calculated formula: C59 H105 Fe K N7 O8 Si4
• Title of publication: The flexible behaviour of a trigonal arylimido iron complex.
• Authors of publication: Gonzalez, Andres; Casnati, Alessandra; Willingshofer, Moritz; Radovic, Aleksa; Cutsail, 3rd, George E; Demeshko, Serhiy; Meyer, Franc; Werncke, C. Gunnar
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 93
• Pages of publication: 18440 - 18443
• a: 18.115 ± 0.0019 Å
• b: 19.364 ± 0.002 Å
• c: 25.348 ± 0.003 Å
• α: 90°
• β: 106.419 ± 0.003°
• γ: 90°
• Cell volume: 8528.9 ± 1.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1159
• Residual factor for significantly intense reflections: 0.0759
• Weighted residual factors for significantly intense reflections: 0.2083
• Weighted residual factors for all reflections included in the refinement: 0.2198
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No