Information card for entry 8105338

Structure parameters

• Chemical name: 2-amino-4,5-dicyanoimidazole sodium (I)
• Formula: C10 H12 Cl0 N10 Na2 O4
• Calculated formula: C10 H12 N10 Na2 O4
• Title of publication: Crystal structure of poly[μ2-diaqua-(μ2-2-amino-4,5-dicyano-κ2 N:N′-imidazol-1-ide)sodium(I)], C5H6N5O2Na
• Authors of publication: Mei, Xue; Jianlong, Wang; Sheng, Yan; Kaixin, Yang; Pengxiang, Gao; Jiale, Duan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 4
• Pages of publication: 943 - 944
• a: 7.014 ± 0.001 Å
• b: 7.4328 ± 0.0013 Å
• c: 8.9483 ± 0.0016 Å
• α: 103.303 ± 0.007°
• β: 103.719 ± 0.006°
• γ: 103.634 ± 0.006°
• Cell volume: 419.73 ± 0.12 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0755
• Residual factor for significantly intense reflections: 0.0622
• Weighted residual factors for significantly intense reflections: 0.1624
• Weighted residual factors for all reflections included in the refinement: 0.1795
• Goodness-of-fit parameter for all reflections included in the refinement: 0.856
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No