Information card for entry 7040829

Structure parameters

• Formula: C16 H31 Cl2 N3 S4 Si
• Calculated formula: C16 H31 Cl2 N3 S4 Si
• Title of publication: Neutral six-coordinate bis(dithiocarbamato)silicon(iv) complexes with an SiCl2S4skeleton
• Authors of publication: Baus, Johannes A.; Tacke, Reinhold
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 9.825 ± 0.006 Å
• b: 19.594 ± 0.015 Å
• c: 13.142 ± 0.009 Å
• α: 90°
• β: 97.87 ± 0.04°
• γ: 90°
• Cell volume: 2506 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0342
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0735
• Weighted residual factors for all reflections included in the refinement: 0.0757
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No