Information card for entry 4312980

Structure parameters

• Formula: C30 H32 Cl4 N4 Pt S2
• Calculated formula: C30 H32 Cl4 N4 Pt S2
• SMILES: c1(ccccc1)S(c1ccccc1)=N/C(=[NH]/[Pt](/[NH]=C(/N=S(c1ccccc1)c1ccccc1)CC)(Cl)(Cl)(Cl)Cl)CC
• 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: 10.9307 ± 0.0004 Å
• b: 12.7847 ± 0.0005 Å
• c: 11.8655 ± 0.0005 Å
• α: 90°
• β: 93.362 ± 0.002°
• γ: 90°
• Cell volume: 1655.3 ± 0.11 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: 0.0172
• Residual factor for significantly intense reflections: 0.0138
• Weighted residual factors for significantly intense reflections: 0.0323
• Weighted residual factors for all reflections included in the refinement: 0.0339
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No