Information card for entry 4335901

Structure parameters

• Chemical name: Di(μ-acetato-κ^2^O,O')-(2-((3-((2-(11H-indolo[3,2-c]quinolin-6-yl-κN^5^) hydrazono-κN^13^)methyl)-5-methyl-2-oxidobenzyl-κO^1^) (2-methoxy-2-oxoethyl-κO^5^)aminoκN^23^) acetato-κO^2^)dizinc(II) dimethanol solvate
• Formula: C35 H39 N5 O11 Zn2
• Calculated formula: C35 H39 N5 O11 Zn2
• SMILES: [Zn]12345[O]6[Zn]7([O]=C(O3)C)(OC(=[O]4)C)[n]3c4ccccc4c4[nH]c8c(c4c3N[N]7=Cc3c6c(cc(c3)C)C[N]5(CC(=O)O1)CC(OC)=[O]2)cccc8.CO.OC
• Title of publication: Dicopper(II) and Dizinc(II) Complexes with Nonsymmetric Dinucleating Ligands Based on Indolo[3,2-c]quinolines: Synthesis, Structure, Cytotoxicity, and Intracellular Distribution
• Authors of publication: Michael F. Primik; Simone Göschl; Samuel M. Meier; Nadine Eberherr; Michael A. Jakupec; Éva A. Enyedy; Ghenadie Novitchi; Vladimir B. Arion
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 10137 - 10146
• a: 10.7024 ± 0.0005 Å
• b: 11.6277 ± 0.0005 Å
• c: 15.4646 ± 0.0008 Å
• α: 99.404 ± 0.003°
• β: 105.532 ± 0.003°
• γ: 94.84 ± 0.003°
• Cell volume: 1812.59 ± 0.15 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0634
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1294
• Weighted residual factors for all reflections included in the refinement: 0.142
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No