Information card for entry 4110353

Structure parameters

• Common name: trans-Pt2-complex
• Chemical name: trans-Pt2-complex
• Formula: C22 H20 N4 O8 Pt2 S2
• Calculated formula: C22 H20 N4 O8 Pt2 S2
• SMILES: c1cccc2C(c3cccc[n]3[Pt]3([n]12)[OH][Pt]1([n]2ccccc2C(c2cccc[n]12)S(=O)(=O)[O-])[OH]3)S(=O)(=O)[O-]
• Title of publication: Stoichiometric Aerobic PtII-Me Bond Cleavage in Aqueous Solutions to Produce Methanol and a PtII(OH) Complex
• Authors of publication: Andrei N. Vedernikov; Seth A. Binfield; Peter Y. Zavalij; Julia R. Khusnutdinova
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 82 - 83
• a: 8.169 ± 0.003 Å
• b: 13.873 ± 0.005 Å
• c: 10.637 ± 0.004 Å
• α: 90°
• β: 94.767 ± 0.007°
• γ: 90°
• Cell volume: 1201.3 ± 0.8 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0357
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0649
• Weighted residual factors for all reflections included in the refinement: 0.0699
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No