Information card for entry 7122644

Structure parameters

• Formula: C21 H42 Co N2
• Calculated formula: C21 H42 Co N2
• Title of publication: [(NHC)CoR₂]: pre-catalysts for homogeneous olefin and alkyne hydrogenation.
• Authors of publication: Enachi, Andreea; Baabe, Dirk; Zaretzke, Marc-Kevin; Schweyen, Peter; Freytag, Matthias; Raeder, Jan; Walter, Marc D.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 98
• Pages of publication: 13798 - 13801
• a: 15.1042 ± 0.0003 Å
• b: 9.823 ± 0.0002 Å
• c: 15.6224 ± 0.0004 Å
• α: 90°
• β: 99.477 ± 0.002°
• γ: 90°
• Cell volume: 2286.24 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0517
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.1083
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No