Information card for entry 4348958

Structure parameters

• Formula: C52 H62 F12 N6 Ni O4
• Calculated formula: C52 H62 F12 N6 Ni O4
• SMILES: [Ni]12(OC(=CC(=[N]1c1ccc(cc1)CCCCCC)C(F)(F)F)C(F)(F)F)(OC(=CC(=[N]2c1ccc(cc1)CCCCCC)C(F)(F)F)C(F)(F)F)([n]1ccc([N](=O)C(C)(C)C)cc1)[n]1ccc([N](=O)C(C)(C)C)cc1
• Title of publication: Diazopyridine‒Ni(ii) complexes exhibiting intra-chain ferromagnetic interaction after irradiation: formation of magnetic gel
• Authors of publication: Mori, Koya; Eguchi, Rumi; Karasawa, Satoru; Koga, Noboru
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2015
• Journal volume: 2
• Journal issue: 10
• Pages of publication: 917
• a: 11.0039 ± 0.0006 Å
• b: 45.083 ± 0.003 Å
• c: 11.3568 ± 0.0007 Å
• α: 90°
• β: 105.098 ± 0.004°
• γ: 90°
• Cell volume: 5439.5 ± 0.6 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0762
• Weighted residual factors for all reflections included in the refinement: 0.1895
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No