Information card for entry 2006690

Structure parameters

• Chemical name: (Imidazole) (N-Salicylidene-α-aminoisobutyrato)-Copper(II) Dimer
• Formula: C14 H15 Cu N3 O3
• Calculated formula: C14 H15 Cu N3 O3
• SMILES: [Cu]12([N](=Cc3c(O1)cccc3)C(C(=O)O2)(C)C)[n]1c[nH]cc1
• Title of publication: (Imidazole-<i>N</i>^3^)(<i>N</i>-salicylidene-α-aminoisobutyrato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II) Dimer
• Authors of publication: Warda, Salam A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 11
• Pages of publication: 1588 - 1590
• a: 9.1844 ± 0.0004 Å
• b: 16.9279 ± 0.0007 Å
• c: 9.3097 ± 0.0004 Å
• α: 90°
• β: 94.489 ± 0.006°
• γ: 90°
• Cell volume: 1442.96 ± 0.11 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: 0.035
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for all reflections: 0.0932
• Weighted residual factors for significantly intense reflections: 0.0924
• Goodness-of-fit parameter for all reflections: 1.087
• Goodness-of-fit parameter for significantly intense reflections: 1.098
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No