Information card for entry 4336851

Structure parameters

• Common name: Zn(ANG)2(ClO4)2(H2O)2
• Chemical name: Bis(3-amino-1-nitroguanidine)zinc(II) perchlorate dihydrate
• Formula: C2 H14 Cl2 N10 O14 Zn
• Calculated formula: C2 H14 Cl2 N10 O14 Zn
• SMILES: C1(N[NH2][Zn]2([N]=1N(=O)=O)([OH2])([NH2]NC(N)=[N]2N(=O)=O)[OH2])N.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=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: 7.9056 ± 0.0005 Å
• b: 12.5134 ± 0.0006 Å
• c: 10.1931 ± 0.0007 Å
• α: 90°
• β: 126.024 ± 0.004°
• γ: 90°
• Cell volume: 815.53 ± 0.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• 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: 0.0457
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for significantly intense reflections: 0.0593
• Weighted residual factors for all reflections included in the refinement: 0.0617
• Goodness-of-fit parameter for all reflections included in the refinement: 0.909
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No