Information card for entry 2007376

Structure parameters

• Chemical name: Aqua(2,4-dimethylpyridine((N-salicylideneglycinato)copper(II)
• Formula: C16 H18 Cu N2 O4
• Calculated formula: C16 H18 Cu N2 O4
• SMILES: [Cu]12([OH2])([N](=Cc3c(O1)cccc3)CC(=O)O2)[n]1c(cc(cc1)C)C
• Title of publication: Aqua(2,4-dimethylpyridine-<i>N</i>)(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)
• Authors of publication: Warda, Salam A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 6
• Pages of publication: 768 - 770
• a: 13.0786 ± 0.0008 Å
• b: 12.174 ± 0.0007 Å
• c: 9.9027 ± 0.0009 Å
• α: 90°
• β: 94.354 ± 0.008°
• γ: 90°
• Cell volume: 1572.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0507
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for all reflections: 0.101
• Goodness-of-fit parameter for all reflections: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No