Information card for entry 4115448

Structure parameters

• Formula: C12 H20 I6 N4 Pt S4
• Calculated formula: C12 H20 I6 N4 Pt S4
• SMILES: C12C(N(CCN1C)C)=[S][Pt]1([S]=2)[S]=C2C(N(CCN2C)C)=[S]1.I[I-]I.I[I-]I
• Title of publication: N,N'-Dimethylpiperazinium-2,3-dithione Triiodide, [Me2Pipdt]I3, as a Powerful New Oxidation Agent toward Metallic Platinum. Synthesis and X-ray Structures of the Reagent and the Product [Pt(Me2Pipdt)2](I3)2
• Authors of publication: Francesco Bigoli; Paola Deplano; Maria Laura Mercuri; Maria Angela Pellinghelli; Gloria Pintus; Angela Serpe; Emanuele F. Trogu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2001
• Journal volume: 123
• Pages of publication: 1788 - 1789
• a: 9.072 ± 0.006 Å
• b: 13.303 ± 0.005 Å
• c: 12.611 ± 0.005 Å
• α: 90°
• β: 107.99 ± 0.02°
• γ: 90°
• Cell volume: 1447.5 ± 1.3 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: 0.1365
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1248
• Weighted residual factors for all reflections included in the refinement: 0.1393
• Goodness-of-fit parameter for all reflections included in the refinement: 0.676
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No