Information card for entry 7710251

Structure parameters

• Formula: C69 H79 La N6 O24 Zn2
• Calculated formula: C63 H63 La N6 O21 Zn2
• SMILES: [La]1234567([O]8[Zn]9%10%11([OH]Cc%12c([N]%10=Cc%10c([O]39)c([O]2C)ccc%10)cccc%12)[OH]Cc2c([N]%11=Cc3c8c([O]1C)ccc3)cccc2)([O]=C(O7)C)[O](c1cccc2C=[N]3[Zn]78([OH]Cc9c3cccc9)([O]5c3c([O]4C)cccc3C=[N]8c3c(cccc3)C[OH]7)[O]6c12)C.O=N(=O)[O-].O=N(=O)[O-].OC
• 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: 12.6542 ± 0.0008 Å
• b: 13.2334 ± 0.0008 Å
• c: 21.8815 ± 0.0009 Å
• α: 85.739 ± 0.004°
• β: 87.26 ± 0.004°
• γ: 61.849 ± 0.006°
• Cell volume: 3221.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0683
• Residual factor for significantly intense reflections: 0.0509
• Weighted residual factors for significantly intense reflections: 0.1219
• Weighted residual factors for all reflections included in the refinement: 0.1359
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No