Information card for entry 1569749

Structure parameters

• Formula: C24 H34 Si2
• Calculated formula: C24 H34 Si2
• SMILES: C1C2(CCC1(C2)c1ccc(cc1)[Si](C)(C)C)c1ccc(cc1)[Si](C)(C)C
• Title of publication: Synthesis of polysubstituted bicyclo[2.1.1]hexanes enabling access to new chemical space.
• Authors of publication: Reinhold, Marius; Steinebach, Justin; Golz, Christopher; Walker, Johannes C. L.
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 36
• Pages of publication: 9885 - 9891
• a: 29.688 ± 0.002 Å
• b: 6.2911 ± 0.0005 Å
• c: 11.942 ± 0.0008 Å
• α: 90°
• β: 90.063 ± 0.003°
• γ: 90°
• Cell volume: 2230.4 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0452
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0929
• Weighted residual factors for all reflections included in the refinement: 0.0993
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No