Information card for entry 7700878

Structure parameters

• Formula: C54 H62 Cl2 Cu2 N8 O2 S2
• Calculated formula: C54 H62 Cl2 Cu2 N8 O2 S2
• Title of publication: Biological evaluation of optically pure chiral binuclear copper(ii) complexes based on a rosin derivative as highly potential anticancer agents.
• Authors of publication: Fei, Bao-Li; Tu, Shuangyan; Wei, Zuzhuang; Wang, Pingping; Long, Jian-Ying; Qiao, Chunhua; Chen, Zhen-Feng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 41
• Pages of publication: 15646 - 15656
• a: 12.5096 ± 0.0006 Å
• b: 14.2481 ± 0.0008 Å
• c: 32.6019 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5810.9 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0829
• Residual factor for significantly intense reflections: 0.0519
• Weighted residual factors for significantly intense reflections: 0.1193
• Weighted residual factors for all reflections included in the refinement: 0.1275
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No