Information card for entry 7043558

Structure parameters

• Formula: C10 H18 N8 Ni O2
• Calculated formula: C10 H18 N8 Ni O2
• SMILES: C1(N=N(=O)[Ni]2([NH]=1)N(=NC(=[NH]2)N1CCCC1)=O)N1CCCC1
• Title of publication: Metal-mediated Reactions between Dialkylcyanamides and Acetamidoxime Generate Unusual (Nitrosoguanidinate)Nickel(II) Complexes
• Authors of publication: Bikbaeva, Zarina M.; Novikov, Alexander S.; Suslonov, Vitalii V.; Bokach, Nadezhda A.; Kukushkin, Vadim Yu.
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 6.7068 ± 0.001 Å
• b: 6.7518 ± 0.0012 Å
• c: 7.8797 ± 0.001 Å
• α: 75.399 ± 0.013°
• β: 81.175 ± 0.012°
• γ: 81.118 ± 0.014°
• Cell volume: 338.7 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0445
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.0991
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No