Information card for entry 1556744

Structure parameters

• Formula: C22 H30 O8 S3 Si2
• Calculated formula: C22 H30 O8 S3 Si2
• Title of publication: Crystal chemistry of layered structures formed by linear rigid silyl-capped molecules.
• Authors of publication: Lumpi, Daniel; Kautny, Paul; Stöger, Berthold; Fröhlich, Johannes
• Journal of publication: IUCrJ
• Year of publication: 2015
• Journal volume: 2
• Journal issue: Pt 5
• Pages of publication: 584 - 600
• a: 10.5399 ± 0.0004 Å
• b: 13.8276 ± 0.0005 Å
• c: 19.9987 ± 0.0008 Å
• α: 79.94 ± 0.002°
• β: 84.589 ± 0.002°
• γ: 89.771 ± 0.002°
• Cell volume: 2856.81 ± 0.19 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.053
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0413
• Weighted residual factors for all reflections included in the refinement: 0.0422
• Goodness-of-fit parameter for significantly intense reflections: 2.12
• Goodness-of-fit parameter for all reflections included in the refinement: 1.96
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No