Information card for entry 2018665

Structure parameters

• Chemical name: Bis(<i>tert</i>-butyldimethylsilyl)(2,6-diisopropylphenyl)phosphane
• Formula: C24 H47 P Si2
• Calculated formula: C24 H47 P Si2
• SMILES: P([Si](C)(C)C(C)(C)C)([Si](C)(C)C(C)(C)C)c1c(C(C)C)cccc1C(C)C
• Title of publication: Bis(<i>tert</i>-butyldimethylsilyl)(2,6-diisopropylphenyl)phosphane: the first structure of an organophosphane with two <i>tert</i>-butyldimethylsilyl (TBDMS) substituents
• Authors of publication: Boeré, René T.; Taghavikish, Mona
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 10
• Pages of publication: o381 - o382
• a: 10.432 ± 0.003 Å
• b: 11.237 ± 0.003 Å
• c: 11.885 ± 0.003 Å
• α: 80.084 ± 0.002°
• β: 88.989 ± 0.002°
• γ: 88.943 ± 0.002°
• Cell volume: 1372 ± 0.6 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: 0.0352
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.0852
• Weighted residual factors for all reflections included in the refinement: 0.0888
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes