Information card for entry 7115000

Structure parameters

• Common name: 7
• Chemical name: Bis(N,N-dimethylbenzhydrazido-N,O)-bis(trifluoromethylsulfonyl)silicon
• Formula: C20 H22 F6 N4 O8 S2 Si
• Calculated formula: C20 H22 F6 N4 O8 S2 Si
• SMILES: [Si]12([N](C)(C)N=C(c3ccccc3)O1)([N](C)(C)N=C(c1ccccc1)O2)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F
• Title of publication: Equilibrium between neutral hexacoordinate silicon complexes and ionic pentacoordinate siliconium salts through fast dissociation–recombination of the Si–Cl bond
• Authors of publication: Kingston, Vijeyakumar; Gostevskii, Boris; Kalikhman, Inna; Kost, Daniel
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 14
• Pages of publication: 1272
• a: 16.466 ± 0.005 Å
• b: 8.193 ± 0.003 Å
• c: 20.861 ± 0.007 Å
• α: 90°
• β: 102.427 ± 0.007°
• γ: 90°
• Cell volume: 2748.3 ± 1.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.0642
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1202
• Weighted residual factors for all reflections included in the refinement: 0.1258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No