Information card for entry 4079950

Structure parameters

• Formula: C44 H54 Co N4
• Calculated formula: C44 H54 Co N4
• Title of publication: NHC Complexes of Cobalt(II) Relevant to Catalytic C‒C Coupling Reactions
• Authors of publication: Przyojski, Jacob A.; Arman, Hadi D.; Tonzetich, Zachary J.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 3
• Pages of publication: 723
• a: 20.782 ± 0.003 Å
• b: 20.801 ± 0.003 Å
• c: 18.742 ± 0.003 Å
• α: 90°
• β: 107.575 ± 0.002°
• γ: 90°
• Cell volume: 7724 ± 2 ų
• Cell temperature: 98 ± 2 K
• Ambient diffraction temperature: 98 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.05
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1188
• Weighted residual factors for all reflections included in the refinement: 0.123
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No