Information card for entry 7125024

Structure parameters

• Common name: [CrIII2TbIII2(OMe)2-x(OH)x(2-Cl-4,5-F-benz)4(mdea)2(NO3)2]?xMeOH
• Formula: C40 H38.4 Cl4 Cr2 F8 N4 O21.2 Tb2
• Calculated formula: C40 H37.198 Cl4 Cr2 F8 N4 O21.198 Tb2
• Title of publication: Enhancing the magnetic blocking temperature and magnetic coercivity of {CrLn} single-molecule magnets via bridging ligand modification.
• Authors of publication: Langley, Stuart K.; Wielechowski, Daniel P.; Moubaraki, Boujemaa; Murray, Keith S.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 73
• Pages of publication: 10976 - 10979
• a: 9.6481 ± 0.0006 Å
• b: 11.3861 ± 0.0007 Å
• c: 13.3598 ± 0.0008 Å
• α: 67.617 ± 0.005°
• β: 78.339 ± 0.005°
• γ: 87.41 ± 0.005°
• Cell volume: 1328.23 ± 0.15 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0379
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0583
• Weighted residual factors for all reflections included in the refinement: 0.0645
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No