Information card for entry 4317383

Structure parameters

• Formula: C47 H33 F15 N5 O S3 Yb
• Calculated formula: C47 H33 F15 N5 O S3 Yb
• Title of publication: Trivalent Lanthanide Compounds with Fluorinated Thiolate Ligands: Ln-F Dative Interactions Vary with Ln and Solvent
• Authors of publication: Jonathan H. Melman; Christa Rohde; Thomas J. Emge; John G. Brennan
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 28 - 33
• a: 11.513 ± 0.007 Å
• b: 31.499 ± 0.008 Å
• c: 14.144 ± 0.005 Å
• α: 90 ± 0.03°
• β: 112.23 ± 0.04°
• γ: 90 ± 0.03°
• Cell volume: 4748 ± 4 ų
• Cell temperature: 153 ± 5 K
• Ambient diffraction temperature: 153 ± 5 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: 0.0372
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for significantly intense reflections: 0.056
• Weighted residual factors for all reflections included in the refinement: 0.0587
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No