Information card for entry 7009022

Structure parameters

• Formula: C19 H27 Cl13 N8 Si
• Calculated formula: C19 H27 Cl13 N8 Si
• SMILES: [Si](Cl)(Cl)([n]1cn(cc1)C)([n]1cn(cc1)C)([n]1cn(cc1)C)[n]1cn(cc1)C.[Cl-].[Cl-].C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl
• Title of publication: Halogen exchange and expulsion: ligand stabilized dihalogen silicon dications
• Authors of publication: Hensen, Karl; Mayr-Stein, Ralf; Stumpf, Thorsten; Pickel, Peter; Bolte, Michael; Fleischer, Holger
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 4
• Pages of publication: 473
• a: 9.568 ± 0.001 Å
• b: 12.333 ± 0.001 Å
• c: 15.507 ± 0.001 Å
• α: 91.7°
• β: 95.32°
• γ: 100.31°
• Cell volume: 1790.6 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0618
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for all reflections: 0.1109
• Weighted residual factors for significantly intense reflections: 0.102
• Goodness-of-fit parameter for all reflections: 1.03
• Goodness-of-fit parameter for significantly intense reflections: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No