Information card for entry 4303263

Structure parameters

• Formula: C26 H26 F12 Pt S4
• Calculated formula: C26 H26 F12 Pt S4
• SMILES: C1(=C(C(F)(F)F)S[Pt]2(S1)[S]1[C@@](C(F)(F)F)(CC(=C(C1)C)C)[C@]1(C(F)(F)F)CC(=C(C[S]21)C)C)C(F)(F)F.c1ccccc1.C1(=C(C(F)(F)F)S[Pt]2(S1)[S]1[C@](C(F)(F)F)(CC(=C(C1)C)C)[C@@]1(C(F)(F)F)CC(=C(C[S]21)C)C)C(F)(F)F.c1ccccc1
• Title of publication: Ligand-Based Reactivity of a Platinum Bisdithiolene: Double Diene Addition Yields a New C2-Chiral Chelate Ligand
• Authors of publication: Mitchell J. Kerr; Daniel J. Harrison; Alan J. Lough; Ulrich Fekl
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 9043 - 9045
• a: 13.2761 ± 0.0005 Å
• b: 16.6218 ± 0.0009 Å
• c: 14.4963 ± 0.0005 Å
• α: 90°
• β: 110.297 ± 0.002°
• γ: 90°
• Cell volume: 3000.3 ± 0.2 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.072
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.0758
• Weighted residual factors for all reflections included in the refinement: 0.0856
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No