Information card for entry 4319147

Structure parameters

• Common name: PtCl2(C11H14N2O)2
• Formula: C22 H28 Cl2 N4 O2 Pt
• Calculated formula: C22 H28 Cl2 N4 O2 Pt
• SMILES: [Pt](Cl)(Cl)([N]1[C@H](N(OC=1C)C)c1ccc(cc1)C)[N]1[C@H](N(OC=1C)C)c1ccc(cc1)C.[Pt](Cl)(Cl)([N]1[C@@H](N(OC=1C)C)c1ccc(cc1)C)[N]1[C@@H](N(OC=1C)C)c1ccc(cc1)C
• Title of publication: [2 + 3] Cycloaddition of Nitrones to Platinum-Bound Organonitriles: Effect of Metal Oxidation State and of Nitrile Substituent
• Authors of publication: Gabriele Wagner; Matti Haukka; João J. R. Fraústo da Silva; Armando J. L. Pombeiro; Vadim Yu. Kukushkin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 264 - 271
• a: 11.6378 ± 0.0002 Å
• b: 19.0767 ± 0.0007 Å
• c: 11.5782 ± 0.0004 Å
• α: 90°
• β: 111.062 ± 0.002°
• γ: 90°
• Cell volume: 2398.76 ± 0.13 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0525
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0605
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.167
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No