Information card for entry 1519452

Structure parameters

• Common name: copper(II) complex of anthracene-9-imidazoline hydrazone
• Chemical name: cis-[CuCl2(9-AIH)]
• Formula: C20 H18 Cl2 Cu N4 O
• Calculated formula: C20 H22 Cl2 Cu N4 O
• SMILES: [Cu]1([N](NC2=[N]1CCN2)=Cc1c2ccccc2cc2ccccc12)(Cl)Cl.OCC
• Title of publication: Synthesis and antitumor mechanisms of a copper(ii) complex of anthracene-9-imidazoline hydrazone (9-AIH).
• Authors of publication: Qin, Qi-Pin; Liu, Yan-Cheng; Wang, Hai-Lu; Qin, Jiao-Lan; Cheng, Feng-Jie; Tang, Shang-Feng; Liang, Hong
• Journal of publication: Metallomics : integrated biometal science
• Year of publication: 2015
• Journal volume: 7
• Journal issue: 7
• Pages of publication: 1124 - 1136
• a: 11.3306 ± 0.0003 Å
• b: 14.0417 ± 0.0003 Å
• c: 13.3887 ± 0.0005 Å
• α: 90°
• β: 106.842 ± 0.004°
• γ: 90°
• Cell volume: 2038.79 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0563
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1169
• Weighted residual factors for all reflections included in the refinement: 0.1257
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No