Information card for entry 4086130

Structure parameters

• Formula: C26 H25 O P S Si
• Calculated formula: C26 H25 O P S Si
• SMILES: O[Si](C)(C)c1c2c3c(ccc2P(c2ccccc2)(c2ccccc2)=S)CCc3cc1
• Title of publication: Sterically Congested 5-Diphenylphosphinoacenaphth-6-yl-silanes and -silanols
• Authors of publication: Hupf, Emanuel; Lork, Enno; Mebs, Stefan; Beckmann, Jens
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 15
• Pages of publication: 3873
• a: 14.756 ± 0.003 Å
• b: 16.989 ± 0.003 Å
• c: 18.406 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4614.2 ± 1.6 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.0733
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for significantly intense reflections: 0.081
• Weighted residual factors for all reflections included in the refinement: 0.1114
• Goodness-of-fit parameter for all reflections included in the refinement: 0.959
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No