Information card for entry 4074419

Structure parameters

• Common name: 8a
• Chemical name: Bis-(N,N-dimethyl-N-trifluoroacetimidato-ammoniomethyl-C-O)dichlorosilicon (IV)
• Formula: C10 H16 Cl2 F6 N4 O2 Si
• Calculated formula: C10 H16 Cl2 F6 N4 O2 Si
• SMILES: [Si]12(Cl)(Cl)(OC(=N[N+](C1)(C)C)C(F)(F)F)OC(=N[N+](C2)(C)C)C(F)(F)F
• Title of publication: Donor-Stabilized Silyl Cations. 11. Bis-Zwitterionic Penta- and Hexacoordinate Silicon Dichelate Complexes Derived from (ClCH2)2SiCl2through Double Internal Displacement of Chloride1
• Authors of publication: Gostevskii, Boris; Zamstein, Noa; Korlyukov, Alexander A.; Baukov, Yuri I.; Botoshansky, Mark; Kaftory, Menahem; Kocher, Nikolaus; Stalke, Dietmar; Kalikhman, Inna; Kost, Daniel
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 22
• Pages of publication: 5416
• a: 10.251 ± 0.002 Å
• b: 11.918 ± 0.002 Å
• c: 16.501 ± 0.003 Å
• α: 90°
• β: 117.47 ± 0.03°
• γ: 90°
• Cell volume: 1788.7 ± 0.7 ų
• Cell temperature: 240 ± 1 K
• Ambient diffraction temperature: 240 ± 1 K
• Number of distinct elements: 7
• 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: 0.0743
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.1093
• Weighted residual factors for all reflections included in the refinement: 0.1195
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No