Information card for entry 2312829

Structure parameters

• Chemical name: Dichloridobis(propyl 4-{[1-(2-methyl-4-nitrophenyl)-1<i>H</i>-1,2,3-triazol-4-yl]methoxy}benzoate)copper(II)
• Formula: C40 H40 Cl2 Cu N8 O10
• Calculated formula: C40 H40 Cl2 Cu N8 O10
• Title of publication: Synthesis, crystal structure and Hirshfeld surface analysis of a propyl 4-{[1-(2-methyl-4-nitro-phen-yl)-1<i>H</i>-1,2,3-triazol-4-yl]meth-oxy}benzoate copper(II) chloride complex.
• Authors of publication: Hakimov, Muminjon; Ortikov, Ilkhomjon; Sattarov, Tulkinjon; Tashkhodjaev, Bakhodir; Tojiboev, Akmaljon
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2025
• Journal volume: 81
• Journal issue: Pt 4
• Pages of publication: 271 - 274
• a: 15.8765 ± 0.0004 Å
• b: 16.2381 ± 0.0003 Å
• c: 8.0187 ± 0.0002 Å
• α: 90°
• β: 92.984 ± 0.002°
• γ: 90°
• Cell volume: 2064.45 ± 0.08 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0659
• Residual factor for significantly intense reflections: 0.0583
• Weighted residual factors for significantly intense reflections: 0.1652
• Weighted residual factors for all reflections included in the refinement: 0.1706
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No