Information card for entry 1545229

Structure parameters

• Formula: C25 H35 N O2 S Si
• Calculated formula: C25 H35 N O2 S Si
• SMILES: C(=C(\c1ccccc1)[SiH](CC)CC)/N(C1CCCCC1)S(=O)(=O)c1ccc(C)cc1
• Title of publication: Borane-Catalyzed Selective Hydrosilylation of Internal Ynamides Leading to β-Silyl (Z)-Enamides.
• Authors of publication: Kim, Youngchan; Dateer, Ramesh B.; Chang, Sukbok
• Journal of publication: Organic letters
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 1
• Pages of publication: 190 - 193
• a: 9.9367 ± 0.0005 Å
• b: 11.6098 ± 0.0006 Å
• c: 12.8011 ± 0.0006 Å
• α: 104.929 ± 0.002°
• β: 105.574 ± 0.002°
• γ: 111.041 ± 0.002°
• Cell volume: 1220.44 ± 0.11 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0513
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.0935
• Weighted residual factors for all reflections included in the refinement: 0.1003
• Goodness-of-fit parameter for all reflections included in the refinement: 0.953
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No