Information card for entry 7108107

Structure parameters

• Formula: C27 H47 Dy N6 O15
• Calculated formula: C27 H47 Dy N6 O15
• SMILES: [Dy]12345(ON(=O)=[O]2)(ON(=[O]3)=O)(ON(=O)=[O]4)Oc2c(cc(cc2C[NH+](CCN(CC[NH+](Cc2cc(cc(c2O5)OC)C)C)C)C)C)[O]1C.CO.CO
• Title of publication: Field and dilution effects on the slow relaxation of a luminescent DyO9 low-symmetry single-ion magnet
• Authors of publication: Jose Ruiz; Antonio J. Mota; Antonio Rodriguez-Dieguez; Silvia Titos; Juan Manuel Herrera; Eliseo Ruiz; Eduard Cremades; Jean Pierre Costes; Enrique Colacio
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 7916
• a: 9.7795 ± 0.001 Å
• b: 12.3752 ± 0.0013 Å
• c: 15.126 ± 0.0016 Å
• α: 76.378 ± 0.001°
• β: 86.18 ± 0.001°
• γ: 81.496 ± 0.001°
• Cell volume: 1758.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0464
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0817
• Weighted residual factors for all reflections included in the refinement: 0.0861
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No