Information card for entry 4300809

Structure parameters

• Common name: PtCl2(NHC(Et)ON(CH2C6H4Cl)2)2
• Formula: C34 H36 Cl6 N4 O2 Pt
• Calculated formula: C34 H36 Cl6 N4 O2 Pt
• SMILES: C(CC)(=[NH][Pt]([NH]=C(CC)ON(Cc1ccc(cc1)Cl)Cc1ccc(cc1)Cl)(Cl)Cl)ON(Cc1ccc(cc1)Cl)Cc1ccc(cc1)Cl
• Title of publication: Kinetic and Mechanistic Study of the Pt(II) versus Pt(IV) Effect in the Platinum-Mediated Nitrile‒Hydroxylamine Coupling
• Authors of publication: Luzyanin, Konstantin V.; Kukushkin, Vadim Yu.; Ryabov, Alexander D.; Haukka, Matti; Pombeiro, Armando J. L.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Journal issue: 8
• Pages of publication: 2944 - 2953
• a: 13.1961 ± 0.0004 Å
• b: 10.3787 ± 0.0002 Å
• c: 13.3755 ± 0.0004 Å
• α: 90°
• β: 101.723 ± 0.001°
• γ: 90°
• Cell volume: 1793.68 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0212
• Residual factor for significantly intense reflections: 0.0195
• Weighted residual factors for significantly intense reflections: 0.0457
• Weighted residual factors for all reflections included in the refinement: 0.0464
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No