Information card for entry 4110773

Structure parameters

• Formula: C38 H59 F3 N2 O3 S Si2
• Calculated formula: C38 H59 F3 N2 O3 S Si2
• SMILES: S(=O)(=O)(O[Si]1(N(C(=C)C=C(N1c1c(cccc1C(C)C)C(C)C)C)c1c(cccc1C(C)C)C(C)C)[Si](C)(C)C)C(F)(F)F.C1CCCC1
• Title of publication: A New Type of N-Heterocyclic Silylene with Ambivalent Reactivity
• Authors of publication: Matthias Driess; Shenglai Yao; Markus Brym; Christoph van Wüllen; Dieter Lentz
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 9628 - 9629
• a: 18.183 ± 0.003 Å
• b: 20.6485 ± 0.0017 Å
• c: 21.68 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8139.8 ± 1.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1042
• Residual factor for significantly intense reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.1069
• Weighted residual factors for all reflections included in the refinement: 0.1171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No