Information card for entry 2016371

Structure parameters

• Chemical name: Poly[bis[μ~3~-benzene-1,3,5-tricarboxylato- κ^3^<i>O</i>^1^:<i>O</i>^3^:<i>O</i>^5^]tris[μ~2~-1,3-bis(imidazol-1- ylmethyl)benzene-κ^2^<i>N</i>:<i>N</i>']tricobalt(II)]
• Formula: C60 H48 Co3 N12 O12
• Calculated formula: C60 H48 Co3 N12 O12
• Title of publication: Poly[bis(μ~3~-benzene-1,3,5-tricarboxylato-κ^3^<i>O</i>^1^:<i>O</i>^3^:<i>O</i>^5^)tris[μ~2~-1,3-bis(imidazol-1-ylmethyl)benzene-κ^2^<i>N</i>:<i>N</i>']tricobalt(II)] and poly[[diaquabis(μ~3~-benzene-1,3,5-tricarboxylato-κ^3^<i>O</i>^1^:<i>O</i>^3^:<i>O</i>^5^)tris[μ~2~-1,4-bis(imidazol-1-ylmethyl)benzene-κ^2^<i>N</i>:<i>N</i>']tricobalt(II)] monohydrate]
• Authors of publication: Ying-Ying Liu; Jin Yang; Ji-Cheng Ma; Jian-Fang Ma
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: m33 - m36
• a: 40.152 ± 0.009 Å
• b: 8.353 ± 0.003 Å
• c: 18.842 ± 0.005 Å
• α: 90°
• β: 113.138 ± 0.009°
• γ: 90°
• Cell volume: 5811 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0443
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.0877
• Weighted residual factors for all reflections included in the refinement: 0.0911
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes