Information card for entry 4307059

Structure parameters

• Chemical name: catena-(Aqua-(μ~2~-trifluoromethanesulfonato-O,O') (μ~3~-tropolonato-O,O,O',O')-lead(II))
• Formula: C8 H7 F3 O6 Pb S
• Calculated formula: C8 H7 F3 O6 Pb S
• SMILES: [Pb]1([O]=C2C(O1)=CC=CC=C2)[OH2].S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Influence of pH and Counteranion on the Structure of Tropolonato-Lead(II) Complexes: Structural and Infrared Characterization of Formed Lead Compounds
• Authors of publication: Krzysztof Lyczko; Wojciech Starosta; Ingmar Persson
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 4402 - 4410
• a: 7.685 ± 0.0015 Å
• b: 8.2317 ± 0.0016 Å
• c: 9.959 ± 0.002 Å
• α: 84.92 ± 0.03°
• β: 77.81 ± 0.03°
• γ: 87.29 ± 0.03°
• Cell volume: 613.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.1046
• Weighted residual factors for all reflections included in the refinement: 0.1105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No