Information card for entry 7033875

Structure parameters

• Formula: C23 H20 Dy N7 O12
• Calculated formula: C23 H20 Dy N7 O12
• SMILES: c1cc2[n]3c(c1)C(=[N]1[Dy]453([O]=C(N[N]5=C2C)c2ccccc2O)(OC(=N1)c1ccccc1O)([OH2])([O]=N(=O)O4)[OH2])C.O=N(=O)[O-]
• Title of publication: Influence of the coordination environment on slow magnetic relaxation and photoluminescence behavior in two mononuclear dysprosium(iii) based single molecule magnets.
• Authors of publication: Mondal, Amit Kumar; Goswami, Soumyabrata; Konar, Sanjit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 11
• Pages of publication: 5086 - 5094
• a: 8.073 ± 0.003 Å
• b: 11.659 ± 0.004 Å
• c: 16.832 ± 0.005 Å
• α: 85.771 ± 0.005°
• β: 85.202 ± 0.007°
• γ: 86.025 ± 0.006°
• Cell volume: 1571.2 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0424
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.1113
• Weighted residual factors for all reflections included in the refinement: 0.1113
• Goodness-of-fit parameter for all reflections included in the refinement: 1.551
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No