Information card for entry 7107159

Structure parameters

• Formula: C18 H27 Co
• Calculated formula: C18 H27 Co
• SMILES: [Co]1234567([c]8([c]1([c]2([c]3([c]48C)C)C)C)C)[CH]1=[CH]5CC[CH]6=[CH]7CC1
• Title of publication: Development of more labile low electron count Co(I) sources: mild, catalytic functionalization of activated alkanes using a [(Cp*Co)2-?-(?4:?4-arene)] complex
• Authors of publication: Fernando Hung-Low; Jeremy Krogman; Jesse Tye; Chris Bradley
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 368
• a: 12.59 ± 0.003 Å
• b: 9.245 ± 0.002 Å
• c: 14.347 ± 0.003 Å
• α: 90°
• β: 112.057 ± 0.004°
• γ: 90°
• Cell volume: 1547.7 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0494
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.0973
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No