Information card for entry 7044001

Structure parameters

• Formula: C39 H60 Dy N7 O6
• Calculated formula: C39 H54 Dy N7 O3
• Title of publication: Synthesis and Characterisation of New Tripodal Lanthanide Complexes and Investigation of Their Optical and Magnetic Properties
• Authors of publication: Craze, Alexander R.; Huang, Xin-Da; Etchells, Isaac; Zheng, Li-Min; Bhadbhade, Mohan; Marjo, Christopher; Clegg, Jack Kay; Moore, Evan G.; Avdeev, Maxim; Lindoy, Leonard F.; Li, Feng
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 12.3876 ± 0.001 Å
• b: 12.3876 ± 0.001 Å
• c: 31.693 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4211.8 ± 0.6 ų
• Cell temperature: 150.02 K
• Ambient diffraction temperature: 150.02 K
• Number of distinct elements: 5
• Space group number: 165
• Hermann-Mauguin space group symbol: P -3 c 1
• Hall space group symbol: -P 3 2"c
• Residual factor for all reflections: 0.0656
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.136
• Weighted residual factors for all reflections included in the refinement: 0.1601
• Goodness-of-fit parameter for all reflections included in the refinement: 1.328
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No