Information card for entry 7123902

Structure parameters

• Formula: C15 H24 Cl O5 P Si2 W
• Calculated formula: C15 H24 Cl O5 P Si2 W
• Title of publication: Competitive or sequential reaction of an electrophilic terminal phosphinidene metal(0) complex with allyl halides? [2+1]-Cycloaddition vs C-X bond insertion
• Authors of publication: Khan, Arif; Junker, Philip; Schnakenburg, Gregor; Espinosa, Arturo; Streubel , R.
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 18.1955 ± 0.0006 Å
• b: 13.3383 ± 0.0005 Å
• c: 18.5737 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4507.8 ± 0.3 ų
• Cell temperature: 100.15 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 7
• 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: 0.0239
• Residual factor for significantly intense reflections: 0.0217
• Weighted residual factors for significantly intense reflections: 0.0484
• Weighted residual factors for all reflections included in the refinement: 0.0492
• Goodness-of-fit parameter for all reflections included in the refinement: 1.171
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No