Information card for entry 7713674

Structure parameters

• Formula: C36 H22 Br2 Cl2 Cu N8 O2
• Calculated formula: C36 H22 Br2 Cl2 Cu N8 O2
• SMILES: Brc1nc(N(N2[Cu]34(Oc5ccc(Cl)cc5C=[N]4N=C2c2c(O)ccc(Cl)c2)[n]2cccc4ccc5ccc[n]3c5c24)c2nc(Br)ccc2)ccc1
• Title of publication: Hydrazylpyridine salicylaldehyde-copper(II)-1,10-phenanthroline complexes as potential anticancer agents: synthesis, characterization and anticancer evaluation
• Authors of publication: Chen, Yating; Ke, zhilin; Yuan, Lingyu; Liang, Meixiang; Zhang, Shuhua
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 11.4592 ± 0.001 Å
• b: 12.1673 ± 0.0011 Å
• c: 14.7545 ± 0.0014 Å
• α: 111.949 ± 0.004°
• β: 103.209 ± 0.004°
• γ: 103.135 ± 0.004°
• Cell volume: 1742.7 ± 0.3 ų
• Cell temperature: 301 ± 2 K
• Ambient diffraction temperature: 301 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: 0.0514
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.0943
• Weighted residual factors for all reflections included in the refinement: 0.1036
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No