Information card for entry 2206868

Structure parameters

• Chemical name: 10-(tert-Butyldimethylsilyl)-4,6-bis(diphenylphosphino)phenoxazine
• Formula: C42 H41 N O P2 Si
• Calculated formula: C42 H41 N O P2 Si
• SMILES: P(c1cccc2N([Si](C)(C)C(C)(C)C)c3cccc(P(c4ccccc4)c4ccccc4)c3Oc12)(c1ccccc1)c1ccccc1
• Title of publication: 10-(<i>tert</i>-Butyldimethylsilyl)-4,6-bis(diphenylphosphino)phenoxazine
• Authors of publication: Osiński, Piotr W.; Schürmann, Markus; Preut, Hans; Haag, Rainer; Eilbracht, Peter
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 10
• Pages of publication: o3115 - o3116
• a: 18.8748 ± 0.0018 Å
• b: 10.8973 ± 0.001 Å
• c: 19.1042 ± 0.0015 Å
• α: 90°
• β: 109.139 ± 0.005°
• γ: 90°
• Cell volume: 3712.2 ± 0.6 ų
• Cell temperature: 291 ± 1 K
• Ambient diffraction temperature: 291 ± 1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1542
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.0619
• Weighted residual factors for all reflections included in the refinement: 0.0793
• Goodness-of-fit parameter for all reflections included in the refinement: 0.988
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes