Information card for entry 2008612

Structure parameters

• Common name: none
• Chemical name: Bis(3-acetylamino-1,2,4-triazole-O,N^4^) dinitratocopper (II)
• Formula: C8 H12 Cu N10 O8
• Calculated formula: C8 H12 Cu N10 O8
• SMILES: [Cu]12([n]3c(n[nH]c3)NC(C)=[O]1)(ON(=O)=O)([n]1c(n[nH]c1)NC(C)=[O]2)ON(=O)=O
• Title of publication: Bis(3-acetylamino-1,2,4-triazole-<i>O</i>,<i>N</i>^4^)bis(nitrato-<i>O</i>)copper(II)
• Authors of publication: Virovets, Alexander V.; Naumov, Dmitry Yu.; Lavrenova, Ludmila G.; Bushuev, Mark B.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 6
• Pages of publication: IUC9900059
• a: 8.1525 ± 0.0005 Å
• b: 7.9948 ± 0.0005 Å
• c: 12.7269 ± 0.0006 Å
• α: 90°
• β: 108.008 ± 0.004°
• γ: 90°
• Cell volume: 788.87 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.04
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for all reflections included in the refinement: 0.104
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No