Information card for entry 7714660

Structure parameters

• Formula: C21 H15 Cu N2 O5
• Calculated formula: C21 H15 Cu N2 O5
• Title of publication: Fabrication of multinuclear copper cluster-based coordination polymers as urease inhibitors.
• Authors of publication: Duan, Wen-Long; Wang, Kai-Tong; Yan, Feng; Luan, Jian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 1336 - 1345
• a: 9.5561 ± 0.0008 Å
• b: 10.8019 ± 0.0009 Å
• c: 11.0894 ± 0.001 Å
• α: 79.438 ± 0.003°
• β: 79.785 ± 0.003°
• γ: 66.454 ± 0.003°
• Cell volume: 1024.7 ± 0.15 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1269
• Residual factor for significantly intense reflections: 0.0601
• Weighted residual factors for significantly intense reflections: 0.1436
• Weighted residual factors for all reflections included in the refinement: 0.178
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No