Information card for entry 4302956

Structure parameters

• Formula: C68 H44 N8 Na O8 Yb
• Calculated formula: C68 H44 N8 Na O8 Yb
• SMILES: [Yb]12345([O](c6cccc7c6[n]8c(cc7)c6oc7cc(ccc7[n]76)C)[Na]6789[O]1c1cccc7c1[n]9c(cc7)c1oc7cc(ccc7[n]61)C)(Oc1cccc6c1[n]2c(cc6)c1oc2cc(ccc2[n]41)C)Oc1c2[n]5c(ccc2ccc1)c1oc2cc(ccc2[n]13)C
• Title of publication: Surprisingly Bright Near-Infrared Luminescence and Short Radiative Lifetimes of Ytterbium in Hetero-Binuclear Yb-Na Chelates
• Authors of publication: Nail M. Shavaleev; Rosario Scopelliti; Frédéric Gumy; Jean-Claude G. Bünzli
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 7937 - 7946
• a: 21.621 ± 0.004 Å
• b: 12.22 ± 0.002 Å
• c: 24.913 ± 0.004 Å
• α: 90°
• β: 101.425 ± 0.011°
• γ: 90°
• Cell volume: 6451.8 ± 1.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0867
• Residual factor for significantly intense reflections: 0.0604
• Weighted residual factors for significantly intense reflections: 0.1183
• Weighted residual factors for all reflections included in the refinement: 0.1262
• Goodness-of-fit parameter for all reflections included in the refinement: 1.145
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No