Information card for entry 2209771

Structure parameters

• Chemical name: catena-Poly[[(di-2-pyridylamine-κ^2^N,N')copper(I)]-μ-isothiocyanato- κ^2^S:S]
• Formula: C11 H9 Cu N4 S
• Calculated formula: C11 H9 Cu N4 S
• SMILES: [Cu]1(SC#N)([n]2ccccc2Nc2[n]1cccc2)[S]([Cu]1[n]2c(Nc3[n]1cccc3)cccc2)C#N
• Title of publication: <i>catena</i>-Poly[[(di-2-pyridylamine-κ^2^<i>N</i>,<i>N</i>')copper(I)]-μ-isothiocyanato-κ^2^<i>S</i>:<i>S</i>]
• Authors of publication: Zhou, Rui; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m1873 - m1874
• a: 17.432 ± 0.001 Å
• b: 3.8123 ± 0.0003 Å
• c: 16.734 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1112.07 ± 0.13 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0431
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.1026
• Weighted residual factors for all reflections included in the refinement: 0.105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes