Information card for entry 4102695

Structure parameters

• Formula: C67 H58 O15 Si10
• Calculated formula: C67 H58 O15 Si10
• Title of publication: Nano Building Blocks via Iodination of [PhSiO1.5]n, Forming [p-I-C6H4SiO1.5]n (n = 8, 10, 12), and a New Route to High-Surface-Area, Thermally Stable, Microporous Materials via Thermal Elimination of I2
• Authors of publication: M. F. Roll; J. W. Kampf; Y. Kim; E. Yi; R. M. Laine
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 10171 - 10183
• a: 12.5377 ± 0.0009 Å
• b: 24.6836 ± 0.0017 Å
• c: 35.061 ± 0.002 Å
• α: 72.706 ± 0.0001°
• β: 80.434 ± 0.0001°
• γ: 81.395 ± 0.0001°
• Cell volume: 10157.9 ± 1.2 ų
• Cell temperature: 85 ± 2 K
• Ambient diffraction temperature: 85 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0561
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.1001
• Weighted residual factors for all reflections included in the refinement: 0.1094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No