Information card for entry 2241779

Structure parameters

• Chemical name: <i>catena</i>-Poly[[aquabis(4-cyanobenzoato-κ<i>O</i>)copper(II)]-μ-<i>N</i>,<i>N</i>-diethylnicotinamide-κ^2^<i>N</i>^1^:<i>O</i>]
• Formula: C26 H24 Cu N4 O6
• Calculated formula: C26 H24 Cu N4 O6
• Title of publication: Crystal structure of <i>catena</i>-poly[[aquabis(4-cyanobenzoato-κ<i>O</i>)copper(II)]-μ-<i>N</i>,<i>N</i>-diethylnicotinamide-κ^2^<i>N</i>^1^:<i>O</i>]
• Authors of publication: Akduran, Nurcan; Necefoğlu, Hacali; Aydoğdu, Ömer; Hökelek, Tuncer
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 8
• Pages of publication: 1183 - 1186
• a: 14.6207 ± 0.0004 Å
• b: 8.016 ± 0.0003 Å
• c: 22.2892 ± 0.0005 Å
• α: 90°
• β: 101.725 ± 0.003°
• γ: 90°
• Cell volume: 2557.78 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0658
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.0943
• Weighted residual factors for all reflections included in the refinement: 0.1027
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes