Information card for entry 2243753

Structure parameters

• Common name: (bpy)Cu(2-(hydroxymethyl)tartronate)
• Chemical name: [(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')[2-hydroxy-2-(hydroxymethyl-κ<i>O</i>)propanedioato-κ^2^<i>O</i>^1^,<i>O</i>^3^]copper(II)]
• Formula: C14 H12 Cu N2 O6
• Calculated formula: C14 H12 Cu N2 O6
• SMILES: [Cu]123([n]4c(c5[n]3cccc5)cccc4)OC(=O)C(O)(C(=O)O2)C[OH]1
• Title of publication: A copper complex of an unusual hydroxy‒carboxylate ligand: [Cu(bpy)(C~4~H~4~O~6~)]
• Authors of publication: Gao, Sen; Fronczek, Frank R.; Maverick, Andrew W.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2021
• Journal volume: 77
• Journal issue: 3
• Pages of publication: 282 - 285
• a: 7.6516 ± 0.0005 Å
• b: 9.9272 ± 0.0006 Å
• c: 10.0722 ± 0.0006 Å
• α: 95.204 ± 0.004°
• β: 107.729 ± 0.004°
• γ: 111.462 ± 0.004°
• Cell volume: 660.34 ± 0.08 ų
• Cell temperature: 90 ± 0.5 K
• Ambient diffraction temperature: 90 ± 0.5 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: 0.0974
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.0912
• Weighted residual factors for all reflections included in the refinement: 0.1049
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes