Information card for entry 7713261

Structure parameters

• Formula: C87 H144 N7 O3 Yb
• Calculated formula: C87 H144 N7 O3 Yb
• SMILES: [Yb]123456Oc7c(C=[N]5CC[N]4(CC[N]1=Cc1cc(C)cc(/C=N/CCCCCCCCCCCCCCCCCC)c1O2)CC[N]6=Cc1c(O3)c(/C=N/CCCCCCCCCCCCCCCCCC)cc(C)c1)cc(cc7/C=N/CCCCCCCCCCCCCCCCCC)C
• Title of publication: Long aliphatic chain derivatives of trigonal lanthanide complexes.
• Authors of publication: Zhou, Yiwei; Buch, Christian D.; Hansen, Steen H.; Piligkos, Stergios
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 25
• Pages of publication: 8792 - 8799
• a: 12.4294 ± 0.0008 Å
• b: 12.4635 ± 0.0008 Å
• c: 30.023 ± 0.002 Å
• α: 91.216 ± 0.002°
• β: 98.672 ± 0.002°
• γ: 115.93 ± 0.002°
• Cell volume: 4115 ± 0.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0259
• Residual factor for significantly intense reflections: 0.0219
• Weighted residual factors for significantly intense reflections: 0.0521
• Weighted residual factors for all reflections included in the refinement: 0.0539
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No