Information card for entry 2225894

Structure parameters

• Chemical name: {<i>N</i>-[(2-Oxido-1-naphthyl)methylidene]serinato- κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')copper(II)
• Formula: C26 H19 Cu N3 O4
• Calculated formula: C26 H19 Cu N3 O4
• SMILES: [Cu]123([N]([C@H](C(=O)O2)CO)=Cc2c(O3)ccc3c2cccc3)[n]2cccc3c2c2[n]1cccc2cc3
• Title of publication: {<i>N</i>-[(2-Oxido-1-naphthyl)methylidene]serinato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)
• Authors of publication: Li, Jinghong; Guo, Zhenghua; Li, Lianzhi; Wang, Daqi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: m516
• a: 10.7302 ± 0.0012 Å
• b: 6.4687 ± 0.0006 Å
• c: 15.793 ± 0.0017 Å
• α: 90°
• β: 91.924 ± 0.001°
• γ: 90°
• Cell volume: 1095.6 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0506
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.0941
• Goodness-of-fit parameter for all reflections included in the refinement: 0.973
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes