Information card for entry 2223337

Structure parameters

• Common name: 9,10-Bis[<i>N</i>-ethylimidazoliumethoxyl]anthracene Diiodide
• Chemical name: 3,3'-Diethyl-1,1'-[anthracene-9,10-diylbis(oxyethylene)]diimidazolium diiodide
• Formula: C28 H32 I2 N4 O2
• Calculated formula: C28 H32 I2 N4 O2
• SMILES: CCn1c[n+](cc1)CCOc1c2ccccc2c(c2ccccc12)OCC[n+]1cn(CC)cc1.[I-].[I-]
• Title of publication: 3,3'-Diethyl-1,1'-[anthracene-9,10-diylbis(oxyethylene)]diimidazolium diiodide
• Authors of publication: Hou, Yanhui
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 10
• Pages of publication: o2593
• a: 11.4733 ± 0.0013 Å
• b: 10.6692 ± 0.0012 Å
• c: 13.1553 ± 0.0015 Å
• α: 90°
• β: 112.725 ± 0.002°
• γ: 90°
• Cell volume: 1485.3 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0617
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.0941
• Weighted residual factors for all reflections included in the refinement: 0.1022
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes