Information card for entry 4318439

Structure parameters

• Formula: C6 H18 As F6 N3 O S
• Calculated formula: C6 H18 As F6 N3 O S
• SMILES: [As](F)(F)(F)([F-])(F)F.S(=O)(=[N+](C)C)(N(C)C)N(C)C
• Title of publication: Tris(dimethylamino)oxosulfonium Difluorotrimethylsilicate, (Me2N)3SO+Me3SiF2- (TAOS Fluoride)
• Authors of publication: Jens Wessel; Ulrich Behrens; Enno Lork; Tobias Borrmann; Wolf-Dieter Stohrer; Rüdiger Mews
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 4715 - 4721
• a: 11.184 ± 0.002 Å
• b: 13.531 ± 0.004 Å
• c: 18.696 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2829.3 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0753
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for all reflections: 0.0884
• Weighted residual factors for significantly intense reflections: 0.0822
• Goodness-of-fit parameter for all reflections: 0.818
• Goodness-of-fit parameter for significantly intense reflections: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No