Information card for entry 4086127

Structure parameters

• Formula: C26 H25 P S Si
• Calculated formula: C26 H25 P S Si
• SMILES: c1c(P(=S)(c2c3c4c(cc2)CCc4ccc3[SiH](C)C)c2ccccc2)cccc1
• 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: 14.6595 ± 0.0005 Å
• b: 16.7453 ± 0.0007 Å
• c: 18.1488 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4455.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0688
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.0875
• Weighted residual factors for all reflections included in the refinement: 0.0976
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No