Information card for entry 7104654

Structure parameters

• Common name: Yb-PVDC-2
• Formula: C78 H60 O18 Yb2
• Calculated formula: C78 H60 O18 Yb2
• Title of publication: Near-infrared emitting ytterbium metal-organic frameworks with tunable excitation properties.
• Authors of publication: White, Kiley A; Chengelis, Demetra A; Zeller, Matthias; Geib, Steven J; Szakos, Jessica; Petoud, Stéphane; Rosi, Nathaniel L
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 30
• Pages of publication: 4506 - 4508
• a: 16.0798 ± 0.0014 Å
• b: 22.7096 ± 0.0019 Å
• c: 38.484 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14053 ± 2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.1046
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.2103
• Weighted residual factors for all reflections included in the refinement: 0.2528
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No