Information card for entry 4350717

Structure parameters

• Formula: C120 H214 Er2 Fe2 K2 N4 O22 Si4
• Calculated formula: C120 H214 Er2 Fe2 K2 N4 O22 Si4
• Title of publication: Tetraanionic biphenyl lanthanide complexes as single-molecule magnets.
• Authors of publication: Huang, Wenliang; Le Roy, Jennifer J.; Khan, Saeed I.; Ungur, Liviu; Murugesu, Muralee; Diaconescu, Paula L.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 5
• Pages of publication: 2374 - 2382
• a: 17.257 ± 0.0019 Å
• b: 22.701 ± 0.003 Å
• c: 34.573 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13544 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.0373
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0723
• Weighted residual factors for all reflections included in the refinement: 0.0747
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No