Information card for entry 4313074

Structure parameters

• Common name: trans-[PtCl4(NH=C(Et)ON=C(H)(C6H2Me3))2]
• Formula: C26 H36 Cl4 N4 O2 Pt
• Calculated formula: C26 H36 Cl4 N4 O2 Pt
• SMILES: [Pt]([NH]=C(CC)O/N=C/c1c(cc(cc1C)C)C)([NH]=C(CC)O/N=C/c1c(cc(cc1C)C)C)(Cl)(Cl)(Cl)Cl
• Title of publication: A Route to 1,2,4-Oxadiazoles and Their Complexes via Platinum-Mediated 1,3-Dipolar Cycloaddition of Nitrile Oxides to Organonitriles
• Authors of publication: Nadezhda A. Bokach; Anatolii V. Khripoun; Vadim Yu. Kukushkin; Matti Haukka; Armando J. L. Pombeiro
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 896 - 903
• a: 10.0441 ± 0.0002 Å
• b: 16.6046 ± 0.0003 Å
• c: 9.2969 ± 0.0002 Å
• α: 90°
• β: 100.47 ± 0.0008°
• γ: 90°
• Cell volume: 1524.7 ± 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: 0.0342
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0566
• Weighted residual factors for all reflections included in the refinement: 0.0607
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No