Information card for entry 4085266

Structure parameters

• Formula: C112.5 H92.75 Co2 F1.75 N2 Si2
• Calculated formula: C112.5 H92.75 Co2 F1.75 N2 Si2
• SMILES: [Co]123456N([Si]([c]78[Co]9%10%11%12(N([Si]([c]%131[cH]6[cH]5[cH]4[cH]3[cH]2%13)(c1ccccc1)c1ccccc1)c1c(cc(cc1C(c1ccccc1)c1ccccc1)C)C(c1ccccc1)c1ccccc1)[cH]7[cH]9[cH]%10[cH]%11[cH]8%12)(c1ccccc1)c1ccccc1)c1c(cc(cc1C(c1ccccc1)c1ccccc1)C)C(c1ccccc1)c1ccccc1.Fc1ccccc1.Fc1ccccc1
• Title of publication: Low-Coordinate Cobalt(I) Complexes Stabilized by an Extremely Bulky Amide Ligand
• Authors of publication: Hicks, Jamie; Jones, Cameron
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 11
• Pages of publication: 2118
• a: 14.93 ± 0.003 Å
• b: 17.23 ± 0.003 Å
• c: 18.81 ± 0.004 Å
• α: 104.15 ± 0.03°
• β: 96.94 ± 0.03°
• γ: 100.74 ± 0.03°
• Cell volume: 4538.9 ± 1.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.084
• Residual factor for significantly intense reflections: 0.0627
• Weighted residual factors for significantly intense reflections: 0.1695
• Weighted residual factors for all reflections included in the refinement: 0.1858
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.7109 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No