Information card for entry 7118953

Structure parameters

• Formula: C25 H24 N6 O6 Zn
• Calculated formula: C25 H24 N6 O6 Zn
• SMILES: c12cccc[n]2[Zn]2([n]3c1cc(c1ccc(N(CC)CC)cc1)cc3c1cccc[n]21)(ON(=O)=O)ON(=O)=O
• Title of publication: Synthesis, crystal structure, cytotoxicity and action mechanism of Zn(ii) and Mn(ii) complexes with 4-([2,2′:6′,2′′-terpyridin]-4′-yl)-N,N-diethylaniline as a ligand
• Authors of publication: Zou, Hua-Hong; Wei, Jun-Guang; Qin, Xiao-Huan; Mo, Shun-Gui; Qin, Qi-Pin; Liu, Yan-Cheng; Liang, Fu-Pei; Zhang, Yun-Liang; Chen, Zhen-Feng
• Journal of publication: Med. Chem. Commun.
• Year of publication: 2016
• Journal volume: 7
• Journal issue: 6
• Pages of publication: 1132
• a: 11.9747 ± 0.0009 Å
• b: 15.8152 ± 0.0006 Å
• c: 14.1457 ± 0.001 Å
• α: 90°
• β: 114.424 ± 0.009°
• γ: 90°
• Cell volume: 2439.2 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0653
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.13
• Weighted residual factors for all reflections included in the refinement: 0.1467
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0081
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No