Information card for entry 4064960

Structure parameters

• Common name: jonsk22
• Chemical name: (dippe)Pt(SMe)2
• Formula: C16 H38 P2 Pt S2
• Calculated formula: C16 H38 P2 Pt S2
• SMILES: [Pt]1([P](CC[P]1(C(C)C)C(C)C)(C(C)C)C(C)C)(SC)SC
• Title of publication: C‒S Bond Activation of Thioesters Using Platinum(0)
• Authors of publication: Kundu, Sabuj; Brennessel, William W.; Jones, William D.
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 19
• Pages of publication: 5147
• a: 10.306 ± 0.003 Å
• b: 13.148 ± 0.003 Å
• c: 15.89 ± 0.004 Å
• α: 90°
• β: 90.427 ± 0.005°
• γ: 90°
• Cell volume: 2153.1 ± 1 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.101
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.084
• Weighted residual factors for all reflections included in the refinement: 0.0966
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No