Information card for entry 7229496

Structure parameters

• Formula: C32 H22 Cl4 Cu2 N6
• Calculated formula: C32 H22 Cl4 Cu2 N6
• SMILES: c12ccc3c(cccc3)[n]1[Cu]1(Cl)([n]3c2[nH]c2ccccc32)[Cl][Cu]2([n]3c4ccccc4ccc3c3[n]2c2c([nH]3)cccc2)([Cl]1)Cl
• Title of publication: Mitochondrial and nuclear DNA dual damage induced by 2-(2′-quinolyl)benzimidazole copper complexes with potential anticancer activity
• Authors of publication: Zhao, Jin'an; Zhi, Shuangcheng; Yu, Huaibin; Mao, Ruina; Hu, Jiyong; Song, Wei; Zhang, Junshuai
• Journal of publication: RSC Advances
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 81
• Pages of publication: 51162
• a: 11.2017 ± 0.0003 Å
• b: 17.1297 ± 0.0004 Å
• c: 9.488 ± 0.0002 Å
• α: 90°
• β: 112.712 ± 0.003°
• γ: 90°
• Cell volume: 1679.4 ± 0.08 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• 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: 0.0476
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.1218
• Weighted residual factors for all reflections included in the refinement: 0.1266
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No