Information card for entry 4131492

Structure parameters

• Formula: C21 H32 N2 O3 Si
• Calculated formula: C21 H32 N2 O3 Si
• SMILES: [Si](OC1C(=O)N(c2ccccc2)COC=1N1CCCCC1)(C(C)(C)C)(C)C
• Title of publication: Divergent Rhodium-Catalyzed Cyclization Reactions of Enoldiazoacetamides with Nitrosoarenes.
• Authors of publication: Cheng, Qing-Qing; Lankelma, Marianne; Wherritt, Daniel; Arman, Hadi; Doyle, Michael P.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• Journal volume: 139
• Journal issue: 29
• Pages of publication: 9839 - 9842
• a: 6.509 ± 0.003 Å
• b: 23.099 ± 0.009 Å
• c: 13.865 ± 0.006 Å
• α: 90°
• β: 91.342 ± 0.006°
• γ: 90°
• Cell volume: 2084.1 ± 1.5 ų
• Cell temperature: 98 K
• Ambient diffraction temperature: 98 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: 0.0688
• Residual factor for significantly intense reflections: 0.0624
• Weighted residual factors for significantly intense reflections: 0.1349
• Weighted residual factors for all reflections included in the refinement: 0.1403
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No