Information card for entry 7209861

Structure parameters

• Formula: C60 H66 Gd2 N8 O12
• Calculated formula: C60 H66 Gd2 N8 O12
• SMILES: c12c(cccc2C=[N]2CC[N]34CC[N]56C3c3c([O]7[Gd]89%1024(O1)[N]1(CC[N]24CC[N]%11=Cc%12c(c(ccc%12)OC)O[Gd]%12674%11(Oc4c(C=[N]%12CC5)cccc4OC)[O]9c4c(C12)cccc4OC)CC[N]8=Cc1cccc(OC)c1O%10)c(OC)ccc3)OC
• Title of publication: Three dinuclear lanthanide(iii) compounds of a polydentate Schiff base ligand: Slow magnetic relaxation behaviour of the DyIII derivative
• Authors of publication: Zhao, Lang; Wu, Jianfeng; Ke, Hongshan; Tang, Jinkui
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 26
• Pages of publication: 5301
• a: 10.5471 ± 0.0005 Å
• b: 11.3694 ± 0.0006 Å
• c: 12.8451 ± 0.0007 Å
• α: 105.556 ± 0.001°
• β: 102.637 ± 0.001°
• γ: 101.969 ± 0.001°
• Cell volume: 1388.74 ± 0.13 ų
• Cell temperature: 191 ± 2 K
• Ambient diffraction temperature: 191 ± 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: 0.0336
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0667
• Weighted residual factors for all reflections included in the refinement: 0.0697
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No