Information card for entry 7113399

Structure parameters

• Common name: 3
• Chemical name: Chloro(cyclohexyl)bis[N-(dimethylamino)trifluoroacetimidato-N,O]silicon(IV)
• Formula: C14 H23 Cl F6 N4 O2 Si
• Calculated formula: C14 H23 Cl F6 N4 O2 Si
• SMILES: [Si]12(Cl)(OC(=N[N]1(C)C)C(F)(F)F)(OC(=N[N]2(C)C)C(F)(F)F)C1CCCCC1
• Title of publication: Neutral and ionic dissociation patterns in hexacoordinate silicon chelates: a model nucleophilic substitution at pentacoordinate silicon.
• Authors of publication: Gostevskii, Boris; Adear, Keren; Sivaramakrishna, Akella; Silbert, Gilad; Stalke, Dietmar; Kocher, Nikolaus; Kalikhman, Inna; Kost, Daniel
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2004
• Journal issue: 14
• Pages of publication: 1644 - 1645
• a: 7.806 ± 0.002 Å
• b: 9.205 ± 0.003 Å
• c: 28.156 ± 0.008 Å
• α: 90°
• β: 94.228 ± 0.006°
• γ: 90°
• Cell volume: 2017.6 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0317
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.0766
• Weighted residual factors for all reflections included in the refinement: 0.0776
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No