Information card for entry 4336849

Structure parameters

• Common name: Cu(ANG)2(ClO4)2(H2O)2
• Chemical name: Bis(3-amino-1-nitroguanidine)copper(II) perchlorate dihydrate
• Formula: C2 H14 Cl2 Cu N10 O14
• Calculated formula: C2 H14 Cl2 Cu N10 O14
• SMILES: C1(N[NH2][Cu]2(OCl(=O)(=O)=O)([NH2]NC(N)=[N]2N(=O)=O)([N]=1N(=O)=O)OCl(=O)(=O)=O)N.O.O
• Title of publication: Transition Metal Complexes of 3-Amino-1-nitroguanidine as Laser Ignitible Primary Explosives: Structures and Properties
• Authors of publication: Niko Fischer; Manuel Joas; Thomas M. Klapötke; Jörg Stierstorfer
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 13791 - 13802
• a: 7.5926 ± 0.0006 Å
• b: 7.7551 ± 0.0006 Å
• c: 7.8619 ± 0.0006 Å
• α: 72.087 ± 0.007°
• β: 74.101 ± 0.007°
• γ: 77.206 ± 0.007°
• Cell volume: 418.84 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 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: 0.0399
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0718
• Goodness-of-fit parameter for all reflections included in the refinement: 0.957
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No