Information card for entry 4326527

Structure parameters

• Formula: C20 H21 Br N P Si
• Calculated formula: C20 H21 Br N P Si
• SMILES: BrP(=N[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(C)C
• Title of publication: Reactions of Phosphine Oxides with Bromophosphoranimines; Synthesis and Unusual Rearrangements of O-Donor Stabilized Phosphoranimine Cations
• Authors of publication: Martin Bendle; Keith Huynh; Mairi F. Haddow; Ian Manners
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 10292 - 10302
• a: 16.395 ± 0.002 Å
• b: 9.219 ± 0.0012 Å
• c: 13.7655 ± 0.0017 Å
• α: 90°
• β: 105.461 ± 0.006°
• γ: 90°
• Cell volume: 2005.3 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0277
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.0608
• Weighted residual factors for all reflections included in the refinement: 0.0633
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No