Information card for entry 7045325

Structure parameters

• Common name: GdL'-OMe
• Formula: C18 H27 Gd N12 O11
• Calculated formula: C18 H27 Gd N12 O11
• SMILES: C1C[N]2=Cc3c[nH]c[n]3[Gd]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: 8.5307 ± 0.0011 Å
• b: 11.6511 ± 0.0016 Å
• c: 14.664 ± 0.002 Å
• α: 109.625 ± 0.002°
• β: 94.477 ± 0.002°
• γ: 100.2 ± 0.002°
• Cell volume: 1336.2 ± 0.3 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: 0.042
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0685
• Weighted residual factors for all reflections included in the refinement: 0.0717
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No