Information card for entry 2232339

Structure parameters

• Chemical name: Dibromidobis(3,5-dimethyl-1<i>H</i>-pyrazole-κ<i>N</i>^2^)cobalt(II)
• Formula: C10 H16 Br2 Co N4
• Calculated formula: C10 H16 Br2 Co N4
• SMILES: Br[Co](Br)([n]1[nH]c(cc1C)C)[n]1[nH]c(cc1C)C
• Title of publication: Dibromidobis(3,5-dimethyl-1<i>H</i>-pyrazole-κ<i>N</i>^2^)cobalt(II)
• Authors of publication: Tomyn, Stefania; Pavlenko, Vadim A.; Gumienna-Kontecka, Elżbieta; Penkova, Larysa; Kotova, Natalia V.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: m1491
• a: 8.4729 ± 0.0004 Å
• b: 14.149 ± 0.0008 Å
• c: 12.528 ± 0.0006 Å
• α: 90°
• β: 100.152 ± 0.004°
• γ: 90°
• Cell volume: 1478.38 ± 0.13 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0601
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0659
• Weighted residual factors for all reflections included in the refinement: 0.0721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes