Information card for entry 7039656

Structure parameters

• Formula: C32 H33 Cl3 Cu2 N12 O17
• Calculated formula: C32 H31 Cl3 Cu2 N12 O17
• SMILES: [Cu]1234[N](NC(=O)CCC5=[O][Cu]678([N](NC(=[O]6)CCC(=N[N]2=Cc2[n]3cccc2)O1)=Cc1[n]7cccc1)[N](N5)=Cc1[n]8cccc1)=Cc1[n]4cccc1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].O
• Title of publication: Synthesis, structure, magnetic and biological activity studies of bis-hydrazone derived Cu(ii) and Co(ii) coordination compounds.
• Authors of publication: Golla, Upendarrao; Adhikary, Amit; Mondal, Amit Kumar; Tomar, Raghuvir Singh; Konar, Sanjit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 29
• Pages of publication: 11849 - 11863
• a: 16.9852 ± 0.0007 Å
• b: 17.3596 ± 0.0008 Å
• c: 17.1867 ± 0.0008 Å
• α: 90°
• β: 107.345 ± 0.003°
• γ: 90°
• Cell volume: 4837.2 ± 0.4 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0644
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1366
• Weighted residual factors for all reflections included in the refinement: 0.1451
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No