Information card for entry 7228972

Structure parameters

• Chemical name: Yb Monomer
• Formula: C30 H22 N3 O7 S3 Yb
• Calculated formula: C30 H22 N3 O7 S3 Yb
• Title of publication: Synthesis, structure, and photoluminescent behaviour of molecular lanthanide‒2-thiophenecarboxylate‒2,2′:6′,2′′-terpyridine materials
• Authors of publication: Batrice, Rami J.; Ridenour, J. August; Ayscue III, R. Lee; Bertke, Jeffery A.; Knope, Karah E.
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 8.4238 ± 0.0004 Å
• b: 20.2807 ± 0.0009 Å
• c: 17.5653 ± 0.0008 Å
• α: 90°
• β: 98.119 ± 0.002°
• γ: 90°
• Cell volume: 2970.8 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0442
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for significantly intense reflections: 0.0519
• Weighted residual factors for all reflections included in the refinement: 0.0553
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No