Information card for entry 4336847

Structure parameters

• Common name: Ni(ANG)2(ClO4)2(H2O)2
• Chemical name: Bis(3-amino-1-nitroguanidine)nickel(II) perchlorate dihydrate
• Formula: C2 H14 Cl2 N10 Ni O14
• Calculated formula: C2 H14 Cl2 N10 Ni O14
• SMILES: [Ni]12([OH2])([OH2])([NH2]NC(N)=[N]1N(=O)=O)[NH2]NC(N)=[N]2N(=O)=O.Cl(=O)(=O)(=O)[O-].Cl(=O)(=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: 16.0756 ± 0.0005 Å
• b: 8.3203 ± 0.0003 Å
• c: 12.2323 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1636.12 ± 0.09 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0491
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0539
• Weighted residual factors for all reflections included in the refinement: 0.0563
• Goodness-of-fit parameter for all reflections included in the refinement: 0.875
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No