Information card for entry 4519101

Structure parameters

• Formula: C30 H55 Co P2
• Calculated formula: C30 H55 Co P2
• SMILES: [Co]123([P](C4CCCCC4)(C4CCCCC4)CC[P]1(C1CCCCC1)C1CCCCC1)[CH](=[CH]2C3)C
• Title of publication: Regioselective Access to α-Vinylsilanes and α-Vinylgermanes by Cobalt-Catalyzed Migratory Hydrofunctionalization of 2-Alkynes
• Authors of publication: Sahoo, Manoj Kumar; Kim, Dongwook; Chang, Sukbok; Park, Jung-Woo
• Journal of publication: ACS Catalysis
• Year of publication: 2021
• Journal volume: 11
• Journal issue: 20
• Pages of publication: 12777 - 12784
• a: 9.1738 ± 0.0017 Å
• b: 10.045 ± 0.002 Å
• c: 17.518 ± 0.003 Å
• α: 90.845 ± 0.006°
• β: 96.983 ± 0.006°
• γ: 114.712 ± 0.006°
• Cell volume: 1451.7 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1602
• Residual factor for significantly intense reflections: 0.1351
• Weighted residual factors for significantly intense reflections: 0.3143
• Weighted residual factors for all reflections included in the refinement: 0.3252
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No