Information card for entry 2016476

Structure parameters

• Chemical name: (2,6-Diacetylpyridine bis{[2-(hydroxyimino)propanoyl]hydrazone}(2-)]nickel(II) dimethyl sulfoxide solvate monohydrate
• Formula: C17 H25 N7 Ni O6 S
• Calculated formula: C17 H25 N7 Ni O6 S
• SMILES: [Ni]123[N](NC(=O)C(=NO)C)=C(c4[n]1c(ccc4)C(=NN2C(=O)C(=N3=O)C)C)C.O=S(C)C.O
• Title of publication: A square-planar Ni^II^ complex with an asymmetric coordination of a novel polynucleative 2,6-diacetylpyridine bis{[2-(hydroxyimino)propanoyl]hydrazone} ligand
• Authors of publication: Plutenko, Maxym V.; Moroz, Yurii S.; Sliva, Tetyana Yu.; Haukka, Matti; Fritsky, Igor O.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 3
• Pages of publication: m137 - m139
• a: 7.3076 ± 0.0002 Å
• b: 11.1899 ± 0.0005 Å
• c: 13.9875 ± 0.0006 Å
• α: 74.652 ± 0.002°
• β: 84.472 ± 0.002°
• γ: 73.641 ± 0.002°
• Cell volume: 1058.04 ± 0.07 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0849
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.109
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes