Information card for entry 4336848

Structure parameters

• Common name: Zn(ANG)2(NO3)2(H2O)2
• Chemical name: Bis(3-amino-1-nitroguanidine)zinc(II) nitrate dihydrate
• Formula: C2 H14 N12 O12 Zn
• Calculated formula: C2 H14 N12 O12 Zn
• SMILES: C1(N[NH2][Zn]2([N]=1N(=O)=O)([NH2]NC(N)=[N]2N(=O)=O)([OH2])[OH2])N.N(=O)(=O)[O-].N(=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: 7.0614 ± 0.0005 Å
• b: 7.1953 ± 0.0004 Å
• c: 8.8214 ± 0.0005 Å
• α: 94.681 ± 0.005°
• β: 94.13 ± 0.005°
• γ: 119.274 ± 0.007°
• Cell volume: 386.42 ± 0.05 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0198
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0463
• Weighted residual factors for all reflections included in the refinement: 0.0468
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No