Information card for entry 2226280

Structure parameters

• Chemical name: <i>catena</i>-Poly[[bis(nitrato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)]- μ-4,4'-bis(pyrazol-1-ylmethyl)biphenyl-κ^2^<i>N</i>^2^:<i>N</i>^2'^]
• Formula: C20 H18 Co N6 O6
• Calculated formula: C20 H18 Co N6 O6
• SMILES: [Co]12(ON(=[O]1)=O)(ON(=[O]2)=O)[n]1n(ccc1)Cc1ccc(cc1)c1ccc(cc1)Cn1[n](ccc1)[Co]12(ON(=[O]1)=O)(ON(=[O]2)=O)[n]1n(ccc1)Cc1ccc(c2ccc(Cn3nccc3)cc2)cc1
• Title of publication: <i>catena</i>-Poly[[bis(nitrato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)]-μ-4,4'-bis(pyrazol-1-ylmethyl)biphenyl-κ^2^<i>N</i>^2^:<i>N</i>^2'^]
• Authors of publication: Gao, Jin-Sheng; Wang, Xue; Ding, Zhi-Yong; Hou, Guang-Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 6
• Pages of publication: m718
• a: 14.133 ± 0.006 Å
• b: 13.631 ± 0.008 Å
• c: 10.806 ± 0.005 Å
• α: 90°
• β: 96.211 ± 0.018°
• γ: 90°
• Cell volume: 2069.5 ± 1.8 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0476
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.085
• Weighted residual factors for all reflections included in the refinement: 0.0913
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes