Information card for entry 7244391

Structure parameters

• Formula: C24 H18 N2 O6 Zn
• Calculated formula: C24 H18 N2 O6 Zn
• SMILES: [Zn]1(OC(=O)c2occc2)(OC(=O)c2occc2)[n]2c3c4[n]1c(ccc4ccc3ccc2C)C
• Title of publication: What are the prospects for using complexes of copper(ii) and zinc(ii) to suppress the vital activity of Mycolicibacterium smegmatis?
• Authors of publication: Lutsenko, Irina A.; Baravikov, Dmitry E.; Koshenskova, Kseniya A.; Kiskin, Mikhail A.; Nelyubina, Yulia V.; Primakov, Petr V.; Voronina, Yulia K.; Garaeva, Veronika V.; Aleshin, Dmytry A.; Aliev, Teimur M.; Danilenko, Valery N.; Bekker, Olga B.; Eremenko, Igor L.
• Journal of publication: RSC Advances
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 9
• Pages of publication: 5173 - 5183
• a: 9.622 ± 0.003 Å
• b: 10.595 ± 0.003 Å
• c: 11.815 ± 0.003 Å
• α: 78.455 ± 0.005°
• β: 76.399 ± 0.005°
• γ: 65.951 ± 0.005°
• Cell volume: 1061.7 ± 0.5 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.0511
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0823
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No