Information card for entry 7001385

Structure parameters

• Common name: Bis(2-(3,5-dimethylpyrazol-1-yl)ethyl)etherdinitratocopper
• Chemical name: Bis[2-(3,5-dimethylpyrazol-1-yl)ethyl]etherdinitratocopper
• Formula: C14 H22 Cu N6 O7
• Calculated formula: C14 H22 Cu N6 O7
• SMILES: Cc1cc(C)n2CC[O]3[Cu]([n]12)([n]1c(C)cc(C)n1CC3)(ON(=O)=O)ON(=O)=O
• Title of publication: Synthesis, characterization and potent superoxide dismutase-like activity of novel bis(pyrazole)–2,2′-bipyridyl mixed ligand copper(ii) complexes
• Authors of publication: Potapov, Andrei S.; Nudnova, Evgenia A.; Domina, Galina A.; Kirpotina, Liliya N.; Quinn, Mark T.; Khlebnikov, Andrei I.; Schepetkin, Igor A.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 23
• Pages of publication: 4488 - 4498
• a: 17.4261 ± 0.0007 Å
• b: 10.3459 ± 0.0003 Å
• c: 11.1392 ± 0.0003 Å
• α: 90°
• β: 107.12 ± 0.001°
• γ: 90°
• Cell volume: 1919.29 ± 0.11 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0239
• Residual factor for significantly intense reflections: 0.0222
• Weighted residual factors for significantly intense reflections: 0.0594
• Weighted residual factors for all reflections included in the refinement: 0.0602
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No