Information card for entry 2234866

Structure parameters

• Chemical name: <i>catena</i>-Poly[[[aqua[3-(3-hydroxyphenyl)prop-2-enoato]samarium(III)]- bis[μ~2~-3-(3-hydroxyphenyl)prop-2-enoato]] monohydrate]
• Formula: C27 H25 O11 Sm
• Calculated formula: C27 H25 O11 Sm
• SMILES: [Sm]123([O]=C(O1)/C=C/c1cccc(O)c1)([OH2])[O]=C(/C=C/c1cccc(O)c1)[O]3[Sm]134([O]=C(O1)/C=C/c1cccc(O)c1)(OC(/C=C/c1cccc(O)c1)=O)([OH2])([O]=C(/C=C/c1cccc(O)c1)O4)[O]=C(/C=C/c1cccc(O)c1)[O]32.O.O
• Title of publication: <i>catena</i>-Poly[[[aqua[3-(3-hydroxyphenyl)prop-2-enoato]samarium(III)]-bis[μ~2~-3-(3-hydroxyphenyl)prop-2-enoato]] monohydrate]
• Authors of publication: Guo, Jing-ke; Wen, Yi-Hang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: m543 - m544
• a: 7.9411 ± 0.0001 Å
• b: 13.0312 ± 0.0002 Å
• c: 13.6564 ± 0.0002 Å
• α: 97.356 ± 0.001°
• β: 97.12 ± 0.001°
• γ: 103.739 ± 0.001°
• Cell volume: 1343.87 ± 0.03 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.014
• Weighted residual factors for significantly intense reflections: 0.0365
• Weighted residual factors for all reflections included in the refinement: 0.0369
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes