Information card for entry 7710256

Structure parameters

• Formula: C65 H71 N6 Nd O23 Zn2
• Calculated formula: C62 H59 N6 Nd O20 Zn2
• SMILES: [Nd]1234567([O]8[Zn]9%10%11([O]2c2c(C=[N]%11c%11ccccc%11C[OH]%10)cccc2[O]5C)[OH]Cc2c([N]9=Cc5c8c([O]1C)ccc5)cccc2)([O]1[Zn]259([O]4c4c(C=[N]9c9c(cccc9)C[OH]2)cccc4[O]6C)[OH]Cc2c([N]5=Cc4c1c([O]3C)ccc4)cccc2)[O]=C(O7)C.O=N(=O)[O-].N(=O)(=O)[O-]
• Title of publication: Zero-Field Slow Magnetic Relaxation Behavior of Zn2Dy in a Family of Trinuclear Near Linear Zn2Ln Complexes: Synthesis, Experimental and Theoretical Investigations
• Authors of publication: Ahmed, Naushad; Ansari, Kamal Uddin
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 12.7538 ± 0.0003 Å
• b: 13.2632 ± 0.0003 Å
• c: 22.0875 ± 0.0003 Å
• α: 85.715 ± 0.002°
• β: 87.298 ± 0.002°
• γ: 61.566 ± 0.003°
• Cell volume: 3276.05 ± 0.15 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 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: 0.0616
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.1014
• Weighted residual factors for all reflections included in the refinement: 0.1108
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No