Information card for entry 4074001

Structure parameters

• Formula: C22 H30 O3 Si
• Calculated formula: C22 H30 O3 Si
• SMILES: [Si](C)(CC=C)(c1c(cc(cc1C)C)C)c1c(OC)cc(OC)cc1OC
• Title of publication: The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes
• Authors of publication: Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 24
• Pages of publication: 6014
• a: 7.6734 ± 0.0015 Å
• b: 32.416 ± 0.007 Å
• c: 8.3543 ± 0.0017 Å
• α: 90°
• β: 94.62 ± 0.03°
• γ: 90°
• Cell volume: 2071.3 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0544
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.1166
• Weighted residual factors for all reflections included in the refinement: 0.1243
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No