Information card for entry 7117824

Structure parameters

• Common name: tris(diphenylsilylmethyl)triethylbenzene
• Formula: C54 H61 Si3
• Calculated formula: C54 H61 Si3
• Title of publication: A hydrogen bonded molecular capsule versus a 3D network of tripodal organopolysilanols
• Authors of publication: Marina Fukawa; Takayuki Sato; Yoshio Kabe
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 14746
• a: 13.138 ± 0.003 Å
• b: 14.093 ± 0.003 Å
• c: 14.255 ± 0.003 Å
• α: 70.5 ± 0.008°
• β: 84.236 ± 0.01°
• γ: 70.66 ± 0.008°
• Cell volume: 2347.4 ± 0.9 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0716
• Residual factor for significantly intense reflections: 0.0605
• Weighted residual factors for significantly intense reflections: 0.1359
• Weighted residual factors for all reflections included in the refinement: 0.1435
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No