Information card for entry 2242551

Structure parameters

• Common name: Diaqua[bis(2-(2-hydroxyethyl)pyridine-κ2N,O) nickel (II)] dinitrate
• Chemical name: Diaquabis[2-(2-hydroxyethyl)pyridine-κ^2^<i>N</i>,<i>O</i>)nickel(II) dinitrate
• Formula: C14 H22 N4 Ni O10
• Calculated formula: C14 H22 N4 Ni O10
• SMILES: [Ni]12([OH]CCc3[n]1cccc3)([OH]CCc1[n]2cccc1)([OH2])[OH2].O=N(=O)[O-].O=N(=O)[O-]
• Title of publication: A strongly fluorescent Ni^II^ complex with 2-(2-hydroxyethyl)pyridine ligands: synthesis, characterization and theoretical analysis and comparison with a related polymeric Cu^II^ complex
• Authors of publication: Zeghouan, Ouahida; Dems, Mohamed AbdEsselem; Sellami, Seifeddine; Merazig, Hocine; Daran, Jean Claude
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 8
• Pages of publication: 1042 - 1048
• a: 7.782 ± 0.005 Å
• b: 8.185 ± 0.005 Å
• c: 8.811 ± 0.005 Å
• α: 96.785 ± 0.005°
• β: 113.856 ± 0.005°
• γ: 109.14 ± 0.005°
• Cell volume: 464 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0182
• Residual factor for significantly intense reflections: 0.0182
• Weighted residual factors for significantly intense reflections: 0.0506
• Weighted residual factors for all reflections included in the refinement: 0.0506
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes