Information card for entry 7028621

Structure parameters

• Formula: C40 H36 Gd2 N10 O22
• Calculated formula: C40 H36 Gd2 N10 O22
• SMILES: c1(ccc2cccc(c2[nH+]1)O[Gd]1234([O]=N(=O)O1)([O](c1cccc5ccc([nH+]c15)C)[Gd]156(Oc7cccc8ccc([nH+]c78)C)([O]2c2cccc7ccc([nH+]c27)C)(ON(=[O]1)=O)(ON(=[O]5)=O)[O]=N(=O)O6)(ON(=[O]3)=O)ON(=[O]4)=O)C
• Title of publication: Anion effects on the structures and magnetic properties of binuclear lanthanide single-molecule magnets.
• Authors of publication: Yang, Fen; Zhou, Qi; Zeng, Guang; Li, Guanghua; Gao, Lu; Shi, Zhan; Feng, Shouhua
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 3
• Pages of publication: 1238 - 1245
• a: 10.716 ± 0.002 Å
• b: 18.234 ± 0.004 Å
• c: 12.561 ± 0.003 Å
• α: 90°
• β: 109.75 ± 0.03°
• γ: 90°
• Cell volume: 2310 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0261
• Residual factor for significantly intense reflections: 0.021
• Weighted residual factors for significantly intense reflections: 0.0523
• Weighted residual factors for all reflections included in the refinement: 0.0635
• Goodness-of-fit parameter for all reflections included in the refinement: 1.173
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No