Information card for entry 4085924

Structure parameters

• Formula: C236 H300 Br8 Fe4 N12 O6
• Calculated formula: C236 H300 Br8 Fe4 N12 O6
• Title of publication: Mono- and Dinuclear Neutral and Cationic Iron(II) Compounds Supported by an Amidinato-diolefin Ligand: Characterization and Catalytic Application
• Authors of publication: Lichtenberg, Crispin; Adelhardt, Mario; Wörle, Michael; Büttner, Torsten; Meyer, Karsten; Grützmacher, Hansjörg
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 12
• Pages of publication: 3079
• a: 15.5268 ± 0.0005 Å
• b: 20.3772 ± 0.0007 Å
• c: 21.466 ± 0.0006 Å
• α: 61.992 ± 0.003°
• β: 71.252 ± 0.003°
• γ: 83.089 ± 0.003°
• Cell volume: 5674.3 ± 0.4 ų
• Cell temperature: 105.5 ± 0.3 K
• Ambient diffraction temperature: 105.5 ± 0.3 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: 0.1086
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.1832
• Weighted residual factors for all reflections included in the refinement: 0.2056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No