Information card for entry 2311490

Structure parameters

• Chemical name: <i>catena</i>-Poly[[bis(nitrato-κ<i>O</i>)cobalt(II)]bis[μ-bis(pyridin-3-ylmethyl)sulfane-κ^2^<i>N</i>:<i>N</i>']]
• Formula: C24 H24 Co N6 O6 S2
• Calculated formula: C24 H24 Co N6 O6 S2
• SMILES: [Co]1([n]2cccc(c2)CSCc2cccnc2)([n]2cccc(c2)CSCc2ccc[n](c2)[Co]([n]2cccc(c2)CSCc2ccc[n]1c2)(ON(=O)=O)ON(=O)=O)(ON(=O)=O)([n]1cccc(c1)CSCc1cccnc1)ON(=O)=O
• Title of publication: Crystal structure of a looped-chain Co^II coordination polymer: <i>catena</i>-poly[[bis-(nitrato-κ<i>O</i>)cobalt(II)]bis-[μ-bis-(pyridin-3-ylmeth-yl)sulfane-κ²<i>N</i>:<i>N</i>']].
• Authors of publication: Moon, Suk-Hee; Seo, Joobeom; Park, Ki-Min
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2017
• Journal volume: 73
• Journal issue: Pt 11
• Pages of publication: 1700 - 1703
• a: 8.162 ± 0.0007 Å
• b: 8.8158 ± 0.0008 Å
• c: 9.5078 ± 0.0008 Å
• α: 98.531 ± 0.002°
• β: 109.218 ± 0.002°
• γ: 92.062 ± 0.002°
• Cell volume: 636.22 ± 0.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0409
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0834
• Weighted residual factors for all reflections included in the refinement: 0.0877
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No