Information card for entry 2242005

Structure parameters

• Chemical name: Bis{<i>N</i>-[1-(pyridin-2-yl-κ<i>N</i>)ethyl]pyridine-4-carbohydrazonato-κ^2^<i>N</i>',<i>O</i>}nickel(II)‒2,5-dichloroterephthalic acid (1/1)
• Formula: C34 H26 Cl2 N8 Ni O6
• Calculated formula: C34 H26 Cl2 N8 Ni O6
• SMILES: c12cccc[n]2[Ni]234([N](=C1C)N=C(c1ccncc1)O3)[n]1c(C(=[N]2N=C(O4)c2ccncc2)C)cccc1.c1c(Cl)c(C(=O)O)cc(c1C(=O)O)Cl
• Title of publication: Crystal structures of two nickel compounds comprising neutral Ni^II^ hydrazone complexes and dicarboxylic acids
• Authors of publication: Nakanishi, Takumi; Sato, Osamu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2017
• Journal volume: 73
• Journal issue: 2
• Pages of publication: 103 - 106
• a: 7.9596 ± 0.0018 Å
• b: 8.76 ± 0.0017 Å
• c: 24.121 ± 0.004 Å
• α: 76.138 ± 0.008°
• β: 81.803 ± 0.008°
• γ: 87.253 ± 0.009°
• Cell volume: 1616 ± 0.6 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 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: 0.0569
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1256
• Weighted residual factors for all reflections included in the refinement: 0.1298
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes