Information card for entry 7124267

Structure parameters

• Formula: C34 H33 Br Cl Cu N7 Ni O9
• Calculated formula: C34 H33 Br Cl Cu N7 Ni O9
• Title of publication: A Novel Mn-Cu Bimetallic Complex for Enhanced Chemodynamic Therapy with Simultaneous Glutathione Depletion
• Authors of publication: Cao, Shuhua; Fan, Jiangli; Sun, Wen; Li, Fahui; Li, Kaoxue; Tai, Xi-Shi; Peng, Xiaojun
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 12.7078 ± 0.0013 Å
• b: 15.6706 ± 0.0015 Å
• c: 18.6755 ± 0.0018 Å
• α: 90°
• β: 94.217 ± 0.003°
• γ: 90°
• Cell volume: 3708.9 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.2101
• Residual factor for significantly intense reflections: 0.1165
• Weighted residual factors for significantly intense reflections: 0.2409
• Weighted residual factors for all reflections included in the refinement: 0.2798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No