Information card for entry 1505972

Structure parameters

• Formula: C18 H29 N O Si
• Calculated formula: C18 H29 N O Si
• SMILES: [Si]([C@]1([C@@H](NC(=O)[C@@H]1C)C)C)(C)(C)C(c1ccccc1)(C)C.[Si]([C@@]1([C@H](NC(=O)[C@H]1C)C)C)(C)(C)C(c1ccccc1)(C)C
• Title of publication: Stereoselective synthesis of highly substituted gamma-lactams by the [3+2] annulation of alpha-siloxy allylic silanes with chlorosulfonyl isocyanate.
• Authors of publication: Romero, Antonio; Woerpel, K. A.
• Journal of publication: Organic letters
• Year of publication: 2006
• Journal volume: 8
• Journal issue: 10
• Pages of publication: 2127 - 2130
• a: 8.194 ± 0.002 Å
• b: 8.643 ± 0.003 Å
• c: 14.789 ± 0.004 Å
• α: 75.358 ± 0.005°
• β: 83.355 ± 0.005°
• γ: 63.325 ± 0.004°
• Cell volume: 905.5 ± 0.5 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1231
• Residual factor for significantly intense reflections: 0.1111
• Weighted residual factors for significantly intense reflections: 0.3022
• Weighted residual factors for all reflections included in the refinement: 0.3092
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No