Information card for entry 4318981

Structure parameters

• Formula: C23 H23 Cu N5 O4
• Calculated formula: C23 H23 Cu N5 O4
• Title of publication: Synthesis, Structure, and Second-Order Nonlinear Optical Properties of Copper(II) and Palladium(II) Acentric Complexes with N-Salicylidene-N'-aroylhydrazine Tridentate Ligands
• Authors of publication: F. Cariati; U. Caruso; R. Centore; W. Marcolli; A. De Maria; B. Panunzi; A. Roviello; A. Tuzi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 6597 - 6603
• a: 8.576 ± 0.004 Å
• b: 11.143 ± 0.006 Å
• c: 12.99 ± 0.005 Å
• α: 104.44 ± 0.04°
• β: 104.94 ± 0.05°
• γ: 103.58 ± 0.04°
• Cell volume: 1100.6 ± 1 ų
• Cell temperature: 293 ± 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: 0.1354
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for significantly intense reflections: 0.1389
• Weighted residual factors for all reflections included in the refinement: 0.1649
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: Mokα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No