Information card for entry 7105946

Structure parameters

• Formula: C28 H42 Co N4 O2
• Calculated formula: C28 H42 Co N4 O2
• Title of publication: Catalytic dioxygen activation by Co(II) complexes employing a coordinatively versatile ligand scaffold
• Authors of publication: Savita K. Sharma; Philip S. May; Matthew B. Jones; Sheri Lense; Kenneth I. Hardcastle; Cora E. MacBeth
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 1827
• a: 18.779 ± 0.0008 Å
• b: 18.779 ± 0.0008 Å
• c: 35.798 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12624.2 ± 1.3 ų
• Cell temperature: 172 ± 2 K
• Ambient diffraction temperature: 172 ± 2 K
• Number of distinct elements: 5
• Space group number: 98
• Hermann-Mauguin space group symbol: I 41 2 2
• Hall space group symbol: I 4bw 2bw
• Residual factor for all reflections: 0.0665
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1505
• Weighted residual factors for all reflections included in the refinement: 0.1573
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No