Information card for entry 2019485

Structure parameters

• Chemical name: <i>catena</i>-Poly[[dichloridocobalt(II)]-μ-(1,1'-dimethyl-4,4'-bipyrazole-κ^2^<i>N</i>^2^:<i>N</i>^2'^)]
• Formula: C8 H10 Cl2 Co N4
• Calculated formula: C8 H10 Cl2 Co N4
• SMILES: [Co](Cl)(Cl)[n]1n(C)cc(c1)c1cn(C)[n](c1)[Co](Cl)(Cl)[n]1n(C)cc(c1)c1cn(C)nc1
• Title of publication: Cobalt(II) chloride complexes with 1,1'-dimethyl-4,4'-bipyrazole featuring first- and second-sphere coordination of the ligand
• Authors of publication: Domasevitch, Konstantin V.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 3
• Pages of publication: 272 - 276
• a: 8.8762 ± 0.0008 Å
• b: 14.2372 ± 0.0014 Å
• c: 9.5878 ± 0.0009 Å
• α: 90°
• β: 104.964 ± 0.002°
• γ: 90°
• Cell volume: 1170.54 ± 0.19 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.0462
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0807
• Weighted residual factors for all reflections included in the refinement: 0.0835
• Goodness-of-fit parameter for all reflections included in the refinement: 0.961
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes