Information card for entry 4318643

Structure parameters

• Formula: C20 H20 N8 Pt2 S8
• Calculated formula: C20 H20 N8 Pt2 S8
• SMILES: C12=C(N(CCN1C)C)S[Pt]1(S2)SC2=C(N(CCN2C)C)S1.C1(=C(C#N)S[Pt]2(S1)SC(=C(S2)C#N)C#N)C#N
• Title of publication: Ion Pair Charge-Transfer Complexes between Anionic and Cationic Metal-Dithiolenes [M(II) = Pd, Pt]
• Authors of publication: Francesco Bigoli; Paola Deplano; Maria Laura Mercuri; Maria Angela Pellinghelli; Luca Pilia; Gloria Pintus; Angela Serpe; Emanuele F. Trogu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 5241 - 5248
• a: 6.784 ± 0.007 Å
• b: 8.46 ± 0.006 Å
• c: 13.51 ± 0.005 Å
• α: 100.63 ± 0.02°
• β: 104.04 ± 0.02°
• γ: 96.9 ± 0.02°
• Cell volume: 728.2 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0879
• Residual factor for significantly intense reflections: 0.0691
• Weighted residual factors for significantly intense reflections: 0.202
• Weighted residual factors for all reflections included in the refinement: 0.2187
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No