Information card for entry 2210948

Structure parameters

• Formula: C22 H32 Co N10 S2
• Calculated formula: C22 H32 Co N10 S2
• SMILES: [Co](N=C=S)(N=C=S)([n]1cn(cc1)CC)([n]1cn(cc1)CC)([n]1cn(cc1)CC)[n]1cn(cc1)CC
• Title of publication: Tetrakis(1-ethyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)diisothiocyanatocobalt(II)
• Authors of publication: Fa-Qian Liu; Hong-Na Chen; Juan Su; Wei Li; Rong-Xun Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 11
• Pages of publication: m2881 - m2882
• a: 16.096 ± 0.003 Å
• b: 17.769 ± 0.004 Å
• c: 19.759 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5651 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1772
• Residual factor for significantly intense reflections: 0.0777
• Weighted residual factors for significantly intense reflections: 0.1542
• Weighted residual factors for all reflections included in the refinement: 0.1947
• 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