Information card for entry 7720627

Structure parameters

• Formula: C10 H16 Cl2 Cu N8 O10
• Calculated formula: C10 H16 Cl2 Cu N8 O10
• Title of publication: Position-Oriented N-Methylation Engineering: Multidimensional Regulation of Energy-Safety Balance in Energetic Copper Complexes
• Authors of publication: Zhang, Chao; Wang, Tingwei; Li, Shaoqun; Lu, Zu-Jia; Li, Cong; Xu, Meiqi; Zhao, Binshan; Yu, Qiyao; Zhang, Jianguo
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 7.2382 ± 0.0004 Å
• b: 15.0414 ± 0.0017 Å
• c: 18.6792 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2033.7 ± 0.3 ų
• Cell temperature: 122.1 ± 0.1 K
• Ambient diffraction temperature: 122.1 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0488
• Residual factor for significantly intense reflections: 0.0426
• Weighted residual factors for significantly intense reflections: 0.1186
• Weighted residual factors for all reflections included in the refinement: 0.1261
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No