Information card for entry 4312978

Structure parameters

• Common name: PtCl4(NHC(Me)NSPh2)2
• Formula: C28 H28 Cl4 N4 Pt S2
• Calculated formula: C28 H28 Cl4 N4 Pt S2
• SMILES: c1(ccccc1)S(c1ccccc1)=N/C(=[NH]/[Pt](Cl)(/[NH]=C(/N=S(c1ccccc1)c1ccccc1)C)(Cl)(Cl)Cl)C
• Title of publication: Platinum(IV)-Mediated Nitrile-Sulfimide Coupling: A Route to Heterodiazadienes
• Authors of publication: Anastassiya V. Makarycheva-Mikhailova; Nadezhda A. Bokach; Vadim Yu. Kukushkin; Paul F. Kelly; Liam M. Gilby; Maxim L. Kuznetsov; Kathryn E. Holmes; Matti Haukka; Jonathan Parr; Julia M. Stonehouse; Mark R. J. Elsegood; Armando J. L. Pombeiro
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 301 - 311
• a: 10.9079 ± 0.0002 Å
• b: 13.192 ± 0.0002 Å
• c: 10.9699 ± 0.0002 Å
• α: 90°
• β: 94.921 ± 0.0009°
• γ: 90°
• Cell volume: 1572.72 ± 0.05 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.0219
• Residual factor for significantly intense reflections: 0.0182
• Weighted residual factors for significantly intense reflections: 0.0426
• Weighted residual factors for all reflections included in the refinement: 0.0444
• Goodness-of-fit parameter for all reflections included in the refinement: 1.138
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No