Information card for entry 7132366

Structure parameters

• Formula: C17 H23 Co I4 N2
• Calculated formula: C17 H23 Co I4 N2
• Title of publication: Redox-Active Ligand Promoted Electrophile Addition at Cobalt
• Authors of publication: Zou, Minzhu; Waldie, Kate MacKenzie
• Journal of publication: Chemical Communications
• Year of publication: 2023
• a: 8.5525 ± 0.00007 Å
• b: 11.72077 ± 0.00009 Å
• c: 22.80175 ± 0.00018 Å
• α: 90°
• β: 97.4775 ± 0.0007°
• γ: 90°
• Cell volume: 2266.25 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0297
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0759
• Weighted residual factors for all reflections included in the refinement: 0.0769
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No