Information card for entry 7021678

Structure parameters

• Formula: C8 H26 As Er N6 S4
• Calculated formula: C8 H26 As Er N6 S4
• SMILES: [As]1(S[Er]2345(S1)([NH2]CC[NH]2CC[NH]3CC[NH2]4)[NH2]CC[NH2]5)(=S)[S-]
• Title of publication: The syntheses, structures and properties of three new lanthanoid thioarsenates: the only example of thioarsenate acting as a ligand to a lanthanide complex.
• Authors of publication: Zhou, Jian; Liu, Xing; Li, Rong; An, Litao; Hu, Feilong; Chen, Rong; Wei, Yuanchun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 31
• Pages of publication: 11155 - 11162
• a: 9.6537 ± 0.0019 Å
• b: 13.118 ± 0.003 Å
• c: 14.603 ± 0.003 Å
• α: 90°
• β: 97.53 ± 0.03°
• γ: 90°
• Cell volume: 1833.3 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.0518
• Weighted residual factors for all reflections included in the refinement: 0.0544
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No