Information card for entry 4329300

Structure parameters

• Formula: C47 H79 Cl4 N23 O19 Pt2
• Calculated formula: C45 H73 Cl4 N21 O15 Pt2
• SMILES: [Cl-].[Cl-].[Pt]12([NH]=C(O[N]1=C(N)c1ccccc1)N(C)C)[NH]=C(O[N]2=C(N)c1ccccc1)N(C)C.O.O=N(=O)C.O=N(=O)C.O=N(=O)C
• Title of publication: Amidoximes Provide Facile Platinum(II)-Mediated Oxime-Nitrile Coupling
• Authors of publication: Dmitrii S. Bolotin; Nadezhda A. Bokach; Matti Haukka; Vadim Yu. Kukushkin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 5950 - 5964
• a: 14.0868 ± 0.0008 Å
• b: 29.1131 ± 0.0017 Å
• c: 17.3762 ± 0.001 Å
• α: 90°
• β: 100.91 ± 0.003°
• γ: 90°
• Cell volume: 6997.4 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1016
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.131
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 0.99
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No