Information card for entry 4341609

Structure parameters

• Formula: C43 H51 Co2 Dy N6 O16
• Calculated formula: C43 H51 Co2 Dy N6 O16
• SMILES: [Co]12345[N](N=C(O1)c1ccccc1)=Cc1c6[O]2[Dy]2789([O](c6ccc1)C)([O]1[Co]6([N](N=C(O6)c6ccccc6)=Cc6c1c([O]2C)ccc6)([O]=C(O8)C)([O]49C)[O]5C)(OC(=[O]7)C)OC(=[O]3)C.N#CC.N#CC.OC.O
• Title of publication: Field-Induced Multiple Relaxation Mechanism of Co(III)2Dy(III) Compound with the Dysprosium Ion in a Low-Symmetrical Environment.
• Authors of publication: Xue, Shufang; Ungur, Liviu; Guo, Yun-Nan; Tang, Jinkui; Chibotaru, Liviu F.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Pages of publication: 141113141001000
• a: 12.0987 ± 0.0007 Å
• b: 14.2213 ± 0.0008 Å
• c: 14.2303 ± 0.0008 Å
• α: 98.36 ± 0.001°
• β: 105.6 ± 0.001°
• γ: 97.552 ± 0.001°
• Cell volume: 2295.5 ± 0.2 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 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: 0.0564
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.1101
• Weighted residual factors for all reflections included in the refinement: 0.1253
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No