Information card for entry 1504353

Structure parameters

• Formula: C32 H16 F18 N3 O6 Sm
• Calculated formula: C32 H16 F18 N3 O6 Sm
• SMILES: [Sm]1234(OC(=CC(=[O]1)C(F)(F)F)C(F)(F)F)(OC(=CC(=[O]2)C(F)(F)F)C(F)(F)F)([O]=C(C(F)(F)F)C=C(O3)C(F)(F)F)([n]1cccc2ccc3ccc[n]4c3c12)[n]1ccccc1
• Title of publication: Enhanced deep-red luminescence of tris(hexafluoroacetylacetonato)samarium(III) complex with phenanthroline in solution by control of ligand coordination.
• Authors of publication: Hasegawa, Yasuchika; Tsuruoka, Shin-ichi; Yoshida, Takahiko; Kawai, Hideki; Kawai, Tsuyoshi
• Journal of publication: The journal of physical chemistry. A
• Year of publication: 2008
• Journal volume: 112
• Journal issue: 5
• Pages of publication: 803 - 807
• a: 11.5889 ± 0.0003 Å
• b: 17.5357 ± 0.0006 Å
• c: 18.8203 ± 0.0005 Å
• α: 79.3974 ± 0.001°
• β: 84.1179 ± 0.0009°
• γ: 88.0187 ± 0.0012°
• Cell volume: 3739.08 ± 0.19 ų
• Cell temperature: 223.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for all reflections included in the refinement: 0.0942
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No