Information card for entry 4341929

Structure parameters

• Formula: C34 H46 N2 O16 Yb2
• Calculated formula: C34 H46 N2 O16 Yb2
• SMILES: [Yb]1234([O]5[Yb]678(OC(=O)C)([O]=C(O7)C)([O](C)c7cccc(c57)C=[N]2c2ccccc2[N]4=Cc2cccc([O]8C)c2[O]16)OC(=[O]3)C)([OH]C)(OC(=O)C)[OH]C.OC.OC
• Title of publication: Near-IR Luminescence and Field-Induced Single Molecule Magnet of Four Salen-type Ytterbium Complexes.
• Authors of publication: Liu, Tian-Qi; Yan, Peng-Fei; Luan, Fang; Li, Yu-Xin; Sun, Jing-Wen; Chen, Chuan; Yang, Fan; Chen, Han; Zou, Xiao-Yan; Li, Guang-Ming
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 1
• Pages of publication: 221 - 228
• a: 11.62 ± 0.005 Å
• b: 12.541 ± 0.005 Å
• c: 14.103 ± 0.005 Å
• α: 89.023 ± 0.005°
• β: 68.562 ± 0.005°
• γ: 86.208 ± 0.005°
• Cell volume: 1908.7 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0295
• Residual factor for significantly intense reflections: 0.0245
• Weighted residual factors for significantly intense reflections: 0.0521
• Weighted residual factors for all reflections included in the refinement: 0.0547
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No