Information card for entry 4308334

Structure parameters

• Formula: C41 H36 Cl F21 N4 O9 Re Yb
• Calculated formula: C41 H36 Cl F21 N4 O9 Re Yb
• SMILES: [Yb]1234(OC(=CC(=[O]1)C(F)(F)C(F)(F)C(F)(F)F)C(C)(C)C)(OC(=CC(=[O]2)C(F)(F)C(F)(F)C(F)(F)F)C(C)(C)C)(OC(=CC(=[O]3)C(F)(F)C(F)(F)C(F)(F)F)C(C)(C)C)[n]1c2[n]([Re](Cl)([n]3c2[n]4ccc3)(C#[O])(C#[O])C#[O])ccc1
• Title of publication: Syntheses and Crystal Structures of Dinuclear Complexes Containing d-Block and f-Block Luminophores. Sensitization of NIR Luminescence from Yb(III), Nd(III), and Er(III) Centers by Energy Transfer from Re(I)- and Pt(II)-Bipyrimidine Metal Centers
• Authors of publication: Nail M. Shavaleev; Gianluca Accorsi; Dalia Virgili; Zöe R. Bell; Theodore Lazarides; Giuseppe Calogero; Nicola Armaroli; Michael D. Ward
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 61 - 72
• a: 11.791 ± 0.004 Å
• b: 12.177 ± 0.003 Å
• c: 18.722 ± 0.004 Å
• α: 81.78 ± 0.02°
• β: 88.31 ± 0.02°
• γ: 82.889 ± 0.017°
• Cell volume: 2639.8 ± 1.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1226
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1366
• Weighted residual factors for all reflections included in the refinement: 0.1609
• Goodness-of-fit parameter for all reflections included in the refinement: 0.968
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No