Information card for entry 7712045

Structure parameters

• Formula: C6 H5 Cu N11
• Calculated formula: C6 H5 Cu N11
• Title of publication: Coordination polymerization of nitrogen-rich linkers and dicyanamide anions toward energetic coordination polymers with low sensitivities.
• Authors of publication: Xie, Hao-Hui; Wang, Qin; Weng, Jiao-Lin; Yan, Yun-Fan; Bian, Hong-Yi; Huang, Ying; Zheng, Fa-Kun; Qiu, Ren-Hui; Xu, Jian-Gang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 3
• Pages of publication: 818 - 824
• a: 11.5555 ± 0.0006 Å
• b: 7.8169 ± 0.0003 Å
• c: 11.9927 ± 0.0005 Å
• α: 90°
• β: 93.854 ± 0.004°
• γ: 90°
• Cell volume: 1080.83 ± 0.08 ų
• Cell temperature: 296.76 ± 0.1 K
• Ambient diffraction temperature: 296.76 ± 0.1 K
• Number of distinct elements: 4
• 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: 0.0547
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.1023
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No