Information card for entry 7132584

Structure parameters

• Formula: C16 H27 Co F O4 P
• Calculated formula: C16 H27 Co F O4 P
• SMILES: [Co](C#[O])(C#[O])(C#[O])C#[O].[P+](F)(C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Fluorophosphoniums as Lewis acids in organometallic catalysis: application to the carbonylation of β-lactones.
• Authors of publication: Pietraru, Marie-Hélène; Ponsard, Louise; Lentz, Nicolas; Thuéry, Pierre; Nicolas, Emmanuel; Cantat, Thibault
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 8
• Pages of publication: 1043 - 1046
• a: 14.9882 ± 0.0005 Å
• b: 15.8456 ± 0.0005 Å
• c: 16.4634 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3910 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0587
• Residual factor for significantly intense reflections: 0.0353
• Weighted residual factors for significantly intense reflections: 0.0724
• Weighted residual factors for all reflections included in the refinement: 0.0804
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No