Information card for entry 7226774

Structure parameters

• Chemical name: 1
• Formula: C68 H66 N4 O18 Sm2
• Calculated formula: C68 H66 N4 O18 Sm2
• SMILES: c12c(cc(cc2/C=N/CCO)C)C=[N]2CC[OH][Sm]3452([OH]1)([O]=C(O3)c1ccccc1)([O]=C(O4)c1ccccc1)[O]=C(O[Sm]1234([N](=Cc6c(c(cc(c6)C)/C=N/CCO)[OH]1)CC[OH]2)([O]=C(O3)c1ccccc1)([O]=C(O4)c1ccccc1)[O]=C(O5)c1ccccc1)c1ccccc1
• Title of publication: Syntheses, Structures and Magnetic Properties of Symmetrical Schiff-base Supported Dinuclear Ln(III) Compounds
• Authors of publication: Lin, Shuang-Yan; Wang, Chunlai; Xu, Zhikun
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 11.1124 ± 0.0005 Å
• b: 11.4404 ± 0.0005 Å
• c: 13.6416 ± 0.0007 Å
• α: 94.291 ± 0.001°
• β: 112.91 ± 0.001°
• γ: 97.524 ± 0.001°
• Cell volume: 1568.61 ± 0.13 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 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: 0.0428
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0721
• Weighted residual factors for all reflections included in the refinement: 0.0765
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No