Information card for entry 1542419

Structure parameters

• Formula: C24 H35 N O2 Si
• Calculated formula: C24 H35 N O2 Si
• SMILES: [Si](OC1C(=C(Cc2c[nH]c3c2cc(OC)cc3)C)CCC=1C)(C)(C)C(C)(C)C
• Title of publication: Functionalization of Silyldienol Ethers at the γ-Position via 2-Silyloxypentadienyl Cations.
• Authors of publication: Ayala, Caitlan E.; Dange, Nitin S.; Stepherson, Jacob R.; Henry, Jeffrey L.; Fronczek, Frank R.; Kartika, Rendy
• Journal of publication: Organic letters
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 5
• Pages of publication: 1084
• a: 17.0398 ± 0.0008 Å
• b: 9.1263 ± 0.0004 Å
• c: 15.8008 ± 0.0009 Å
• α: 90°
• β: 112.88 ± 0.002°
• γ: 90°
• Cell volume: 2263.9 ± 0.2 ų
• Cell temperature: 90 ± 0.5 K
• Ambient diffraction temperature: 90 ± 0.5 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: 0.1314
• Residual factor for significantly intense reflections: 0.0861
• Weighted residual factors for significantly intense reflections: 0.2374
• Weighted residual factors for all reflections included in the refinement: 0.2894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No