Information card for entry 4301181

Structure parameters

• Formula: C21 H25 N O Si
• Calculated formula: C21 H25 N O Si
• SMILES: [Si](C)(C)(C#Cc1c(N=C2C(=C(C(=O)C(=C2C)C)C)C)cccc1)C
• Title of publication: Conjugated Organometallic Polymer Containing a Redox-Active Center
• Authors of publication: Daniel Fortin; Sébastien Clément; Karl Gagnon; Jean-François Bérubé; Michael P. Stewart; William E. Geiger; Pierre D. Harvey
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 446 - 454
• a: 13.082 ± 0.008 Å
• b: 11.225 ± 0.004 Å
• c: 14.297 ± 0.009 Å
• α: 90°
• β: 112.89 ± 0.05°
• γ: 90°
• Cell volume: 1934 ± 2 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 198 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1892
• Residual factor for significantly intense reflections: 0.0891
• Weighted residual factors for significantly intense reflections: 0.2331
• Weighted residual factors for all reflections included in the refinement: 0.2923
• Goodness-of-fit parameter for all reflections included in the refinement: 0.907
• Diffraction radiation wavelength: 1.54176 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No