Information card for entry 7107995

Structure parameters

• Formula: C35 H55 O P Si
• Calculated formula: C35 H55 O P Si
• SMILES: P(c1c(O[Si](C(C)C)(C(C)C)C(C)C)cccc1)(C12CC3CC(C1)CC(C2)C3)C12CC3CC(C1)CC(C2)C3
• Title of publication: Efficient palladium-catalyzed synthesis of substituted indoles employing a new (silanyloxyphenyl)phosphine ligand
• Authors of publication: Christopher B. Lavery; Robert McDonald; Mark Stradiotto
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 7277
• a: 8.773 ± 0.0001 Å
• b: 23.8938 ± 0.0004 Å
• c: 30.215 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6333.68 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0414
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.1012
• Weighted residual factors for all reflections included in the refinement: 0.1057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No