Information card for entry 7706670

Structure parameters

• Formula: C21 H15 Cl2 Cu F N3 O0.5
• Calculated formula: C21 H15 Cl2 Cu F N3 O0.5
• SMILES: [Cu]12(Cl)(Cl)[n]3ccccc3c3[n]1c(cc(c3)c1ccc(F)cc1)c1[n]2cccc1.O
• Title of publication: Copper chloride complexes with substituted 4'-phenyl-terpyridine ligands: synthesis, characterization, antiproliferative activities and DNA interactions.
• Authors of publication: Li, Jiahe; Yan, Hao; Wang, Zhiyuan; Liu, Rongping; Luo, Baomei; Yang, Dengfeng; Chen, Hailan; Pan, Lixia; Ma, Zhen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 23
• Pages of publication: 8243 - 8257
• a: 9.9712 ± 0.0004 Å
• b: 11.3078 ± 0.0005 Å
• c: 17.6171 ± 0.0006 Å
• α: 79.386 ± 0.003°
• β: 76.853 ± 0.003°
• γ: 86.68 ± 0.003°
• Cell volume: 1900.94 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0468
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.082
• Weighted residual factors for all reflections included in the refinement: 0.0912
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No