Information card for entry 2232603

Structure parameters

• Chemical name: Bis{μ-4-chloro-<i>N</i>'-[(<i>E</i>)-1-(5-chloro-2- oxidophenyl)ethylidene]benzohydrazidato}bis[pyridinecopper(II)]
• Formula: C40 H30 Cl4 Cu2 N6 O4
• Calculated formula: C40 H30 Cl4 Cu2 N6 O4
• SMILES: C1(=N[N]2=C(c3cc(ccc3[O]3[Cu]2(O1)([n]1ccccc1)[O]1[Cu]23([N](=C(c3cc(ccc13)Cl)C)N=C(O2)c1ccc(cc1)Cl)[n]1ccccc1)Cl)C)c1ccc(cc1)Cl
• Title of publication: Bis{μ-4-chloro-<i>N</i>'-[(<i>E</i>)-1-(5-chloro-2-oxidophenyl)ethylidene]benzohydrazidato}bis[pyridinecopper(II)]
• Authors of publication: Chang, Jian-Guo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: m1886
• a: 11.913 ± 0.002 Å
• b: 8.0783 ± 0.0016 Å
• c: 19.997 ± 0.004 Å
• α: 90°
• β: 95.66 ± 0.03°
• γ: 90°
• Cell volume: 1915.1 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0314
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.0618
• Weighted residual factors for all reflections included in the refinement: 0.0644
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes