Information card for entry 2240157

Structure parameters

• Chemical name: Dichloridobis(1,3-diisopropyl-4,5-dimethyl-2<i>H</i>-imidazole-2-thione-κ<i>S</i>)zinc(II)
• Formula: C22 H40 Cl2 N4 S2 Zn
• Calculated formula: C22 H40 Cl2 N4 S2 Zn
• Title of publication: Crystal structure of dichloridobis(1,3-diisopropyl-4,5-dimethyl-2<i>H</i>-imidazole-2-thione-κ<i>S</i>)zinc(II)
• Authors of publication: Flörke, Ulrich; Ahmida, Aziza; Egold, Hans; Henkel, Gerald
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 11
• Pages of publication: m384
• a: 11.997 ± 0.003 Å
• b: 12.885 ± 0.003 Å
• c: 18.217 ± 0.004 Å
• α: 90°
• β: 96.856 ± 0.004°
• γ: 90°
• Cell volume: 2795.9 ± 1.1 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• 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: 0.0801
• Residual factor for significantly intense reflections: 0.0559
• Weighted residual factors for significantly intense reflections: 0.1115
• Weighted residual factors for all reflections included in the refinement: 0.1231
• Goodness-of-fit parameter for all reflections included in the refinement: 0.922
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes