Information card for entry 7703083

Structure parameters

• Formula: C20 H27 Cl2 Cu N3 O
• Calculated formula: C20 H27 Cl2 Cu N3 O
• Title of publication: Cu(ii)-TACN complexes selectively induce antitumor activity in HepG-2 cells via DNA damage and mitochondrial-ROS-mediated apoptosis.
• Authors of publication: Liu, Ming; Song, Xue-Qing; Wu, Yuan-Di; Qian, Jing; Xu, Jing-Yuan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 1
• Pages of publication: 114 - 123
• a: 8.1762 ± 0.0003 Å
• b: 12.406 ± 0.0004 Å
• c: 40.2745 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4085.2 ± 0.2 ų
• Cell temperature: 154.4 ± 0.2 K
• Ambient diffraction temperature: 154.4 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0349
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0686
• Weighted residual factors for all reflections included in the refinement: 0.0718
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No