Information card for entry 4080395

Structure parameters

• Formula: C59 H58 Cl4 N2 P4 S4 Si
• Calculated formula: C59 H58 Cl4 N2 P4 S4 Si
• Title of publication: A Base-Stabilized 2-Silaallene
• Authors of publication: Yang, Yi-Fan; Foo, Cechao; Xi, Hong-Wei; Li, Yongxin; Lim, Kok Hwa; So, Cheuk-Wai
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 7
• Pages of publication: 2267
• a: 20.0694 ± 0.0009 Å
• b: 13.8996 ± 0.0006 Å
• c: 22.8318 ± 0.0008 Å
• α: 90°
• β: 111.954 ± 0.002°
• γ: 90°
• Cell volume: 5907.2 ± 0.4 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 7
• 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: 0.1258
• Residual factor for significantly intense reflections: 0.0741
• Weighted residual factors for significantly intense reflections: 0.2071
• Weighted residual factors for all reflections included in the refinement: 0.2498
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No