Information card for entry 2213668

Structure parameters

• Chemical name: poly[[aquabis{μ~2~-1,1'-bis[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]\ ferrocene-κ^2^<i>N</i>^4^:<i>N</i>^4'^}ethanolcobalt(II)] bis(perchlorate) ethanol trisolvate]
• Formula: C40 H58 Cl2 Co Fe2 N12 O13
• Calculated formula: C40 H58 Cl2 Co Fe2 N12 O13
• Title of publication: A two-dimensional Co^II^ coordination polymer with the ligand 1,1'-bis[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]ferrocene
• Authors of publication: Zhou, Xiao-Li; Meng, Xiang-Ru; Hou, Hong-Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m1717 - m1717
• a: 17.3708 ± 0.0011 Å
• b: 14.225 ± 0.0009 Å
• c: 21.2747 ± 0.0014 Å
• α: 90°
• β: 94.224 ± 0.001°
• γ: 90°
• Cell volume: 5242.7 ± 0.6 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 7
• 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: 0.0916
• Residual factor for significantly intense reflections: 0.0569
• Weighted residual factors for significantly intense reflections: 0.1616
• Weighted residual factors for all reflections included in the refinement: 0.1896
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes