Information card for entry 7213171

Structure parameters

• Formula: C27 H33 O3 P Si
• Calculated formula: C27 H33 O3 P Si
• SMILES: P(=O)([C@@H]1[C@@](O[C@H]([C@@H]1C)C)(O[Si](C)(C)C)c1ccccc1)(c1ccccc1)c1ccccc1.P(=O)([C@H]1[C@](O[C@@H]([C@H]1C)C)(O[Si](C)(C)C)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Stereoselective intramolecular acylation of γ′-benzoyloxyphosphine oxides with an internal chlorotrimethylsilane trap: isolation of silylated tetrahedral intermediates
• Authors of publication: Feeder, Neil; Hutton, Gordon; Nelson, Adam; Warren, Stuart
• Journal of publication: Journal of the Chemical Society, Perkin Transactions 1
• Year of publication: 1999
• Journal issue: 23
• Pages of publication: 3413
• a: 18.753 ± 0.004 Å
• b: 8.349 ± 0.002 Å
• c: 18.019 ± 0.004 Å
• α: 90°
• β: 111.75 ± 0.03°
• γ: 90°
• Cell volume: 2620.4 ± 1.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0947
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for all reflections: 0.1305
• Weighted residual factors for significantly intense reflections: 0.1102
• Goodness-of-fit parameter for all reflections: 1.032
• Goodness-of-fit parameter for significantly intense reflections: 1.133
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No