Information card for entry 4109378

Structure parameters

• Formula: C18 H27 N O2 S Si
• Calculated formula: C18 H27 N O2 S Si
• SMILES: S(=O)(=O)(N1C[C@@]2([C@H]([C@@H]2C1)C)/C=C\[Si](C)(C)C)c1ccc(cc1)C.S(=O)(=O)(N1C[C@]2([C@@H]([C@H]2C1)C)/C=C\[Si](C)(C)C)c1ccc(cc1)C
• Title of publication: Selective Ruthenium-Catalyzed Transformations of Enynes with Diazoalkanes into Alkenylbicyclo[3.1.0]hexanes
• Authors of publication: Florian Monnier; Chloé Vovard-Le Bray; Dante Castillo; Vincent Aubert; Sylvie Dérien; Pierre H. Dixneuf; Loic Toupet; Andrea Ienco; Carlo Mealli
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 6037 - 6049
• a: 13.5714 ± 0.0002 Å
• b: 7.3787 ± 0.0001 Å
• c: 19.5966 ± 0.0004 Å
• α: 90°
• β: 104.157 ± 0.001°
• γ: 90°
• Cell volume: 1902.79 ± 0.06 ų
• Cell temperature: 120 ± 1 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.066
• Residual factor for significantly intense reflections: 0.0509
• Weighted residual factors for significantly intense reflections: 0.1426
• Weighted residual factors for all reflections included in the refinement: 0.1579
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No