Information card for entry 2212604

Structure parameters

• Chemical name: catena-Poly[[bis(3-pyridylmethanol-κN)copper(II)]-μ-oxalato- 1κ^2^O^1^,O^2^:2κ^2^O^1'^,O^2'^]
• Formula: C14 H14 Cu N2 O6
• Calculated formula: C14 H14 Cu N2 O6
• SMILES: [Cu]1([O]=C2C(O1)=[O][Cu]1(O2)([n]2cc(ccc2)CO)([n]2cc(ccc2)CO)OC(=O)C(O1)=O)([n]1cc(ccc1)CO)[n]1cc(ccc1)CO
• Title of publication: <i>catena</i>-Poly[[bis(3-pyridylmethanol-κ<i>N</i>)copper(II)]-μ-oxalato-1κ^2^<i>O</i>^1^,<i>O</i>^2^:2κ^2^<i>O</i>^1'^,<i>O</i>^2'^]
• Authors of publication: Jašková, Jana; Mikloš, Dušan; Segľa, Peter; Sillanpää, Reijo; Moncol, Jan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 3
• Pages of publication: m910 - m912
• a: 8.6551 ± 0.0003 Å
• b: 9.0505 ± 0.0002 Å
• c: 9.9267 ± 0.0003 Å
• α: 100.643 ± 0.001°
• β: 95.348 ± 0.001°
• γ: 94.581 ± 0.001°
• Cell volume: 757.13 ± 0.04 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0455
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0778
• Weighted residual factors for all reflections included in the refinement: 0.1001
• Goodness-of-fit parameter for all reflections included in the refinement: 1.147
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes