Information card for entry 7229210

Structure parameters

• Formula: C24 H48 Cl8 O12 Si8
• Calculated formula: C24 H48 Cl8 O12 Si8
• Title of publication: Solid-state dynamics and single-crystal to single-crystal structural transformations in octakis(3-chloropropyl)octasilsesquioxane and octavinyloctasilsesquioxane.
• Authors of publication: Kowalewska, Anna; Nowacka, Maria; Włodarska, Magdalena; Zgardzinska, B.; Zaleski, Radosław; Oszajca, Marcin; Krajenta, Justyna; Kazmierski, Slawomir
• Journal of publication: Phys. Chem. Chem. Phys.
• Year of publication: 2017
• a: 10.0885 ± 0.0003 Å
• b: 10.2199 ± 0.0003 Å
• c: 12.6232 ± 0.0003 Å
• α: 81.761 ± 0.004°
• β: 74.572 ± 0.003°
• γ: 79.163 ± 0.004°
• Cell volume: 1226.23 ± 0.06 ų
• Cell temperature: 353 K
• Ambient diffraction temperature: 353 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: 0.094
• Residual factor for significantly intense reflections: 0.0775
• Weighted residual factors for all reflections: 0.0667
• Weighted residual factors for significantly intense reflections: 0.0641
• Goodness-of-fit parameter for all reflections: 1.53
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No