Information card for entry 7012688

Structure parameters

• Formula: C15 H18 Dy N3 O9
• Calculated formula: C15 H18 Dy N3 O9
• SMILES: [Dy]123([O]=n4c(O1)cccc4)([O]=n1c(O2)cccc1)([O]=n1c(O3)cccc1)([OH2])[OH2].O
• Title of publication: A solid-state study of eight-coordinate lanthanide(iii) complexes (Ln = Eu, Gd, Tb, Dy) with 1-hydroxy-2-pyridinone
• Authors of publication: Tedeschi, Christine; Azéma, Joëlle; Gornitzka, Heinz; Tisnès, Pierre; Picard, Claude
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 9
• Pages of publication: 1738
• a: 6.3254 ± 0.0002 Å
• b: 11.752 ± 0.0004 Å
• c: 13.6109 ± 0.0005 Å
• α: 103.706 ± 0.001°
• β: 100.737 ± 0.001°
• γ: 104.508 ± 0.001°
• Cell volume: 918.59 ± 0.06 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 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: 0.0192
• Residual factor for significantly intense reflections: 0.0175
• Weighted residual factors for significantly intense reflections: 0.0447
• Weighted residual factors for all reflections included in the refinement: 0.0453
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No