Information card for entry 7715156

Structure parameters

• Formula: C27 H92 Cl6 N12 O40 Zn6
• Calculated formula: C24 H66 Cl6 N12 O30 Zn6
• Title of publication: Anticancer, antioxidant, and antimicrobial studies and molecular docking of a new hexanuclear Zn(II) complex, together with its X-ray crystal analysis.
• Authors of publication: Keypour, Hassan; Zeynali, Hamid; Fatemikia, Hojatollah; Ranjbar, Nika; Karamian, Roya; Rezaei, Mohammad Taher; Gable, Robert William
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 10
• Pages of publication: 4512 - 4525
• a: 24.258 ± 0.005 Å
• b: 14.863 ± 0.003 Å
• c: 18.414 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6639 ± 2 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0753
• Residual factor for significantly intense reflections: 0.0663
• Weighted residual factors for significantly intense reflections: 0.2093
• Weighted residual factors for all reflections included in the refinement: 0.2203
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71076 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No