Information card for entry 4301180

Structure parameters

• Formula: C21 H25 N O Si
• Calculated formula: C21 H25 N O Si
• SMILES: C[Si](C)(C)C#Cc1ccc(cc1)N=C1C(=C(C)C(=O)C(=C1C)C)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: 7.057 ± 0.004 Å
• b: 9.737 ± 0.004 Å
• c: 15.47 ± 0.006 Å
• α: 74.55 ± 0.03°
• β: 84.96 ± 0.04°
• γ: 69.81 ± 0.04°
• Cell volume: 961.6 ± 0.8 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 198 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1544
• Residual factor for significantly intense reflections: 0.0876
• Weighted residual factors for significantly intense reflections: 0.2272
• Weighted residual factors for all reflections included in the refinement: 0.2627
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 1.54176 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No