Information card for entry 2212171

Structure parameters

• Chemical name: Hydroxonium bromide tetrakis(di-<i>tert</i>-butylmethylsilanol) monohydrate
• Formula: C36 H93 Br O6 Si4
• Calculated formula: C36 H93 Br O6 Si4
• Title of publication: Dihydronium bromide tetrakis(di-<i>tert</i>-butylmethylsilanol)
• Authors of publication: Kückmann, Theresa I.; Lerner, Hans-Wolfram; Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 2
• Pages of publication: o422 - o423
• a: 16.4814 ± 0.0008 Å
• b: 16.1107 ± 0.0005 Å
• c: 20.0624 ± 0.001 Å
• α: 90°
• β: 98.51 ± 0.004°
• γ: 90°
• Cell volume: 5268.5 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0631
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1053
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes