Information card for entry 4331858

Structure parameters

• Formula: C14 H37 N5 O6 Pt
• Calculated formula: C14 H37 N5 O6 Pt
• SMILES: C(=O)(C(C)(C)C)N[Pt](CC(=O)C)(C#N)(NC(=O)C(C)(C)C)([NH3])[NH3].O.O.O
• Title of publication: Spectral and Structural Characterization of Amidate-Bridged Platinum−Thallium Complexes with Strong Metal−Metal Bonds
• Authors of publication: Chen, Wanzhi; Liu, Fenghui; Matsumoto, Kazuko; Autschbach, Jochen; Le Guennic, Boris; Ziegler, Tom; Maliarik, Mikhail; Glaser, Julius
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 11
• Pages of publication: 4526 - 4536
• a: 6.845 ± 0.003 Å
• b: 28.021 ± 0.012 Å
• c: 12.533 ± 0.005 Å
• α: 90°
• β: 105.509 ± 0.007°
• γ: 90°
• Cell volume: 2316.3 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0533
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0608
• Weighted residual factors for all reflections included in the refinement: 0.0643
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No