Information card for entry 7008783

Structure parameters

• Formula: C40 H60 Cl2 N16 O16 Y2
• Calculated formula: C40 H60 Cl2 N16 O16 Y2
• SMILES: [Y]12345([n]6c(C=[N]1NC(N)=[O]2)ccc1c6c(ccc1)[O]4[Y]1246([n]7c8c(cccc8ccc7C=[N]1NC(N)=[O]4)[O]52)([O]=CN(C)C)([O]=CN(C)C)ON(=[O]6)=O)([O]=CN(C)C)([O]=N(=O)O3)[O]=CN(C)C.[Cl-].C(=O)N(C)C.[Cl-].C(=O)N(C)C
• Title of publication: 2-[(8-Hydroxyquinolinyl)methylene]hydrazinecarboxamide: expanding the coordination sphere of 8-hydroxyquinoline for coordination of rare-earth metal(iii) ions
• Authors of publication: Albrecht, Markus; Osetska, Olga; Fröhlich, Roland
• Journal of publication: Dalton Transactions
• Year of publication: 2005
• Journal issue: 23
• Pages of publication: 3757
• a: 10.285 ± 0.001 Å
• b: 11.109 ± 0.001 Å
• c: 13.741 ± 0.001 Å
• α: 68.92 ± 0.01°
• β: 68.11 ± 0.01°
• γ: 81.1 ± 0.01°
• Cell volume: 1358.9 ± 0.2 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 198 ± 2 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 all reflections: 0.0815
• Residual factor for significantly intense reflections: 0.0682
• Weighted residual factors for significantly intense reflections: 0.1827
• Weighted residual factors for all reflections included in the refinement: 0.1934
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No