Information card for entry 4084887

Structure parameters

• Chemical name: 1,3-bis(1,1-dimethyloctyl)-1,1,3,3-tetrahydroxydisiloxane
• Formula: C20 H46 O5 Si2
• Calculated formula: C20 H46 O5 Si2
• Title of publication: Silanetriols as Powerful Starting Materials for Selective Condensation to Bulky POSS Cages.
• Authors of publication: Hurkes, Natascha; Bruhn, Clemens; Belaj, Ferdinand; Pietschnig, Rudolf
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 24
• Pages of publication: 7299 - 7306
• a: 7.2195 ± 0.0004 Å
• b: 10.0508 ± 0.0005 Å
• c: 35.0554 ± 0.0017 Å
• α: 90°
• β: 92.856 ± 0.002°
• γ: 90°
• Cell volume: 2540.5 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0755
• Residual factor for significantly intense reflections: 0.0745
• Weighted residual factors for significantly intense reflections: 0.1643
• Weighted residual factors for all reflections included in the refinement: 0.1649
• Goodness-of-fit parameter for all reflections included in the refinement: 1.169
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No