Information card for entry 7005599

Structure parameters

• Formula: C46 H40 F6 N10 O11 Pt S2
• Calculated formula: C46 H38 F6 N10 O11 Pt S2
• SMILES: [Pt]([n]1ccc(cc1)c1ccn(=O)cc1)([n]1ccc(cc1)c1ccn(=O)cc1)([n]1ccc(cc1)c1ccn(=O)cc1)[n]1ccc(cc1)c1ccn(=O)cc1.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.N#CC.N#CC.O
• Title of publication: 4,4'-Bipyridine-N-monoxide. A hybrid ligand for building networks using a combination of metal-ligand and hydrogen-bonding interactions.
• Authors of publication: Hoffart, Dennis J.; Habermehl, Nicolle C.; Loeb, Stephen J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 27
• Pages of publication: 2870 - 2875
• a: 17.559 ± 0.004 Å
• b: 14.088 ± 0.004 Å
• c: 19.738 ± 0.005 Å
• α: 90°
• β: 94.894 ± 0.004°
• γ: 90°
• Cell volume: 4865 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.1524
• Residual factor for significantly intense reflections: 0.0998
• Weighted residual factors for significantly intense reflections: 0.2123
• Weighted residual factors for all reflections included in the refinement: 0.2369
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No