Information card for entry 7715365

Structure parameters

• Formula: C25 H34 F9 N4 O4 Yb
• Calculated formula: C25 H34 F9 N4 O4 Yb
• SMILES: [Yb]123456OC(=CC(=[N]3CC[N]4(CC[N]5=C(C=C(O2)C(F)(F)F)C)CC[N]6=C(C=C(O1)C(F)(F)F)C)C)C(F)(F)F.O(CC)CC
• Title of publication: Volatile lanthanide complexes with fluorinated heptadentate ligands.
• Authors of publication: Zgrabik, Joshua C.; Bhuniya, Balaka; Branstad Phillips, Thomas; Barroso, Jorge; Vlaisavljevich, Bess; Daly, Scott R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 7
• Pages of publication: 2998 - 3009
• a: 19.726 ± 0.0019 Å
• b: 19.9703 ± 0.0019 Å
• c: 15.5564 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6128.2 ± 1 ų
• Cell temperature: 150.15 K
• Ambient diffraction temperature: 150.15 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0447
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.186
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No