Information card for entry 7034744

Structure parameters

• Formula: C29 H30 Cu F6 N3 O2 P
• Calculated formula: C29 H30 Cu F6 N3 O2 P
• SMILES: [Cu]123([n]4ccccc4C[N]1([C@@H](C)c1cccc4c1cccc4)Cc1[n]2cccc1)[O]=C(C=C(O3)C)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Synthesis, characterization, DNA/BSA interactions and anticancer activity of achiral and chiral copper complexes.
• Authors of publication: Zhou, Xue-Quan; Sun, Qian; Jiang, Lin; Li, Si-Tong; Gu, Wen; Tian, Jin-Lei; Liu, Xin; Yan, Shi-Ping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 20
• Pages of publication: 9516 - 9527
• a: 11.948 ± 0.003 Å
• b: 14.11 ± 0.003 Å
• c: 17.229 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2904.6 ± 1.2 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0411
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.0912
• Weighted residual factors for all reflections included in the refinement: 0.0936
• Goodness-of-fit parameter for all reflections included in the refinement: 0.738
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No