Information card for entry 7022945

Structure parameters

• Formula: C15 H16 Cl Cu N3 O2
• Calculated formula: C15 H16 Cl Cu N3 O2
• SMILES: [Cu]12(Cl)([n]3ccccc3C(C)=[N]1N=C(c1ccccc1)O2)[OH]C
• Title of publication: Potentially cytotoxic new copper(II) hydrazone complexes: synthesis, crystal structure and biological properties.
• Authors of publication: Alagesan, Mani; Bhuvanesh, Nattamai S. P.; Dharmaraj, Nallasamy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 19
• Pages of publication: 7210 - 7223
• a: 7.25 ± 0.0007 Å
• b: 9.4099 ± 0.0009 Å
• c: 11.1819 ± 0.001 Å
• α: 85.32 ± 0.006°
• β: 86.289 ± 0.005°
• γ: 81.042 ± 0.005°
• Cell volume: 749.98 ± 0.12 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0677
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.103
• Weighted residual factors for all reflections included in the refinement: 0.1084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No