Information card for entry 1556251

Structure parameters

• Formula: C32 H46 O S Si2
• Calculated formula: C32 H46 O S Si2
• Title of publication: Directed metalation cascade to access highly functionalized thieno[2,3-f]benzofuran and exploration as building blocks for organic electronics.
• Authors of publication: Aeschi, Yves; Li, Hui; Cao, Zhencai; Chen, Songjie; Amacher, Anneliese; Bieri, Nathalie; Özen, Bilal; Hauser, Juerg; Decurtins, Silvio; Tan, Songting; Liu, Shi-Xia
• Journal of publication: Organic letters
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 21
• Pages of publication: 5586 - 5589
• a: 8.9195 ± 0.0001 Å
• b: 15.2543 ± 0.0001 Å
• c: 13.8533 ± 0.0002 Å
• α: 90°
• β: 122.537 ± 0.002°
• γ: 90°
• Cell volume: 1589.05 ± 0.05 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0925
• Residual factor for significantly intense reflections: 0.081
• Weighted residual factors for significantly intense reflections: 0.2325
• Weighted residual factors for all reflections included in the refinement: 0.2443
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No