Information card for entry 4336855

Structure parameters

• Common name: Ni(ANG)2(NO3)2(H2O)4
• Chemical name: Bis(3-amino-1-nitroguanidine)nickel(II) dinitramide tetrahydrate
• Formula: C2 H18 N16 Ni O16
• Calculated formula: C2 H18 N16 Ni O16
• SMILES: C1(N[NH2][Ni]2([N]=1N(=O)=O)([NH2]NC(N)=[N]2N(=O)=O)([OH2])[OH2])N.O=N([O-])=NN(=O)=O.O.N(=N([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: 12.1641 ± 0.0004 Å
• b: 6.5297 ± 0.0002 Å
• c: 13.1323 ± 0.0004 Å
• α: 90°
• β: 111.038 ± 0.003°
• γ: 90°
• Cell volume: 973.54 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• 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: 0.0261
• Residual factor for significantly intense reflections: 0.0224
• Weighted residual factors for significantly intense reflections: 0.055
• Weighted residual factors for all reflections included in the refinement: 0.057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No