Information card for entry 4324492

Structure parameters

• Formula: C29 H41 Co N4 O2
• Calculated formula: C29 H41 Co N4 O2
• SMILES: [Co]1(N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C)(N=O)N=O
• Title of publication: Chemistry of Nitrosyliron Complexes Supported by a β-Diketiminate Ligand
• Authors of publication: Zachary J. Tonzetich; Florent Héroguel; Loi H. Do; Stephen J. Lippard
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 1570 - 1579
• a: 12.59 ± 0.002 Å
• b: 16.24 ± 0.003 Å
• c: 16.649 ± 0.003 Å
• α: 111.071 ± 0.003°
• β: 99.37 ± 0.003°
• γ: 109.899 ± 0.003°
• Cell volume: 2824.7 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1132
• Residual factor for significantly intense reflections: 0.0599
• Weighted residual factors for significantly intense reflections: 0.1235
• Weighted residual factors for all reflections included in the refinement: 0.1465
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No