Information card for entry 7226683

Structure parameters

• Formula: C50 H64 N10 O14 Sm2
• Calculated formula: C50 H64 N10 O14 Sm2
• SMILES: [n]12ccccc2[C@H]2[N]3=Cc4cccc(c4O[Sm]4513([OH]CC)([NH]1[C@H]2c2[n](cccc2)[Sm]2361([N](=Cc1cccc(c1O6)OCC)[C@@H](c1[n]2cccc1)[C@H]([NH]43)c1[n]5cccc1)([OH]CC)[OH]CC)[OH]CC)OCC.N(=O)(=O)[O-].N(=O)(=O)[O-]
• Title of publication: Two samarium(III) complexes with tunable fluorescence from in situ reactions of 2-ethoxy-6-((pyridin-2-ylmethylimino)methyl)phenol with Sm3+ion
• Authors of publication: Qin, Wei; Zheng, Zhi-Peng; Feng, Hai-Xin; Hong, Xu-Jia; Huang, Xia; Peng, Hai-Jun; Cai, Yue-Peng
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 10.675 ± 0.004 Å
• b: 11.181 ± 0.004 Å
• c: 13.204 ± 0.004 Å
• α: 79.82 ± 0.006°
• β: 81.137 ± 0.006°
• γ: 65.029 ± 0.006°
• Cell volume: 1400.6 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0658
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.0994
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No