Information card for entry 4135118

Structure parameters

• Formula: C27 H34 Co N3 O
• Calculated formula: C27 H34 Co N3 O
• Title of publication: Crystal Structure and C-H Bond Cleaving Reactivity of a Mononuclear Co^IV-dinitrate Complex.
• Authors of publication: Kwon, Yubin M.; Lee, Yuri; Evenson, Garrett E.; Jackson, Timothy A.; Wang, Dong
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 8.7684 ± 0.0005 Å
• b: 11.8623 ± 0.0007 Å
• c: 12.2989 ± 0.0007 Å
• α: 89.239 ± 0.003°
• β: 77.878 ± 0.002°
• γ: 77.626 ± 0.002°
• Cell volume: 1221 ± 0.12 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.065
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.1376
• Weighted residual factors for all reflections included in the refinement: 0.1481
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No