Information card for entry 4500408

Structure parameters

• Formula: C12 H20 Ag2 I2 N4 S4
• Calculated formula: C12 H20 Ag2 I2 N4 S4
• SMILES: [I]1[Ag]2([I][Ag]31[S]=C1C(N(CCN1C)C)=[S]3)[S]=C1C(N(CCN1C)C)=[S]2
• Title of publication: Argentophilic Interactions in Mono-, Di-, and Polymeric Ag(I) Complexes withN,N′-Dimethyl-piperazine-2,3-dithione and Iodide
• Authors of publication: Serpe, Angela; Artizzu, Flavia; Marchiò, Luciano; Mercuri, Maria Laura; Pilia, Luca; Deplano, Paola
• Journal of publication: Crystal Growth & Design
• Year of publication: 2011
• Journal volume: 11
• Journal issue: 4
• Pages of publication: 1278
• a: 7.597 ± 0.001 Å
• b: 16.811 ± 0.002 Å
• c: 8.875 ± 0.001 Å
• α: 90°
• β: 96.872 ± 0.005°
• γ: 90°
• Cell volume: 1125.3 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0331
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0637
• Weighted residual factors for all reflections included in the refinement: 0.0676
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No