Information card for entry 7045322

Structure parameters

• Common name: TbL'-OMe
• Formula: C18 H27 N12 O11 Tb
• Calculated formula: C18 H27 N12 O11 Tb
• SMILES: C1C[N]2=Cc3c[nH]c[n]3[Tb]345672([N]1(CC[N]3=Cc1c[nH]c[n]41)C(c1c[nH]c[n]51)OC)([O]=N(=O)O6)ON(=[O]7)=O.CO.N(=O)(=O)[O-]
• Title of publication: A hemiaminal-ether structure stabilized by lanthanide complexes with an imidazole-based Schiff base ligand.
• Authors of publication: Kachi-Terajima, Chihiro; Shimoyama, Takeru; Ishigami, Takahiro; Ikeda, Mari; Habata, Yoichi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 8
• Pages of publication: 2638 - 2645
• a: 8.5547 ± 0.0005 Å
• b: 11.6314 ± 0.0006 Å
• c: 14.5948 ± 0.0008 Å
• α: 109.526 ± 0.001°
• β: 94.341 ± 0.001°
• γ: 100.026 ± 0.001°
• Cell volume: 1333.71 ± 0.13 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: 0.0313
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.0579
• Weighted residual factors for all reflections included in the refinement: 0.0601
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No