Information card for entry 2014538

Structure parameters

• Chemical name: [Bis(methylsulfonyl)amido-κN]bis(2-picoline-κN)copper(I)
• Formula: C14 H20 Cu N3 O4 S2
• Calculated formula: C14 H20 Cu N3 O4 S2
• SMILES: CS(=O)(=O)N(S(=O)(=O)C)[Cu]([n]1c(cccc1)C)[n]1c(cccc1)C
• Title of publication: Polysulfonylamines. CLXXI. [Di(methanesulfonyl)amido-κ<i>N</i>]bis(2-picoline-κ<i>N</i>)copper(I)
• Authors of publication: Jones, Peter G.; Zerbe, Eva-Maria; Wölper, Christoph
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 10
• Pages of publication: m529 - m531
• a: 10.2353 ± 0.0006 Å
• b: 7.7684 ± 0.0004 Å
• c: 23.0287 ± 0.0014 Å
• α: 90°
• β: 102.78 ± 0.004°
• γ: 90°
• Cell volume: 1785.69 ± 0.18 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0355
• Residual factor for significantly intense reflections: 0.0261
• Weighted residual factors for significantly intense reflections: 0.0697
• Weighted residual factors for all reflections included in the refinement: 0.0729
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes