Information card for entry 4083528

Structure parameters

• Formula: C35 H34 B F20 N Si4
• Calculated formula: C35 H34 B F20 N Si4
• SMILES: [N+]([Si](C)(C)C)([Si](C)(C)C)([Si](C)(C)C)[SiH](C)C.[B-](c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F
• Title of publication: Synthesis of the First Persilylated Ammonium Ion, [(Me3Si)3NSi(H)Me2]+, by Silylium-Catalyzed Methyl/Hydrogen Exchange Reactions
• Authors of publication: Labbow, René; Reiß, Fabian; Schulz, Axel; Villinger, Alexander
• Journal of publication: Organometallics
• Year of publication: 2014
• Pages of publication: 140605100750002
• a: 12.0593 ± 0.0003 Å
• b: 19.9706 ± 0.0005 Å
• c: 16.6264 ± 0.0004 Å
• α: 90°
• β: 90.121 ± 0.002°
• γ: 90°
• Cell volume: 4004.15 ± 0.17 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0959
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1431
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No