Information card for entry 2234002

Structure parameters

• Chemical name: <i>catena</i>-Poly[1-butyl-3-methylimidazolium [[dichlorido(methanol- κ<i>O</i>)(propan-2-ol-κ<i>O</i>)lanthanate(III)]-di-μ-chlorido]]
• Formula: C12 H27 Cl4 La N2 O2
• Calculated formula: C12 H27 Cl4 La N2 O2
• SMILES: [La](Cl)(Cl)(Cl)(Cl)([OH]C(C)C)[OH]C.n1(c[n+](cc1)CCCC)C
• Title of publication: <i>catena</i>-Poly[1-butyl-3-methylimidazolium [[dichlorido(methanol-κ<i>O</i>)(propan-2-ol-κ<i>O</i>)lanthanate(III)]-di-μ-chlorido]]
• Authors of publication: Han, Yulun; Dai, Fengrong; Sykes, Andrew G.; May, P. Stanley; Berry, Mary T.; Meng, Qingguo; Lin, Cuikun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 3
• Pages of publication: m292 - m293
• a: 9.5035 ± 0.0006 Å
• b: 10.7413 ± 0.0006 Å
• c: 11.8625 ± 0.0007 Å
• α: 114.009 ± 0.001°
• β: 109.735 ± 0.001°
• γ: 92.857 ± 0.001°
• Cell volume: 1016.2 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0258
• Residual factor for significantly intense reflections: 0.0216
• Weighted residual factors for significantly intense reflections: 0.0473
• Weighted residual factors for all reflections included in the refinement: 0.0488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes