Information card for entry 7063474

Structure parameters

• Formula: C19 H22 Ce N5 Ni O14
• Calculated formula: C19 H22 Ce N5 Ni O14
• Title of publication: Two Ni/Ce complexes based on bicompartmental ligands with field supported slow magnetic relaxation
• Authors of publication: Krešáková, Lenka; Litecká, Miroslava; Oyarzabal, Itziar; Titiš, Ján; Červeňáková, Michaela; Hillard, Elizabeth A.; Robert, Jerome; Černák, Juraj
• Journal of publication: New Journal of Chemistry
• Year of publication: 2024
• a: 7.8894 ± 0.0002 Å
• b: 11.3473 ± 0.0002 Å
• c: 14.4942 ± 0.0002 Å
• α: 93.723 ± 0.001°
• β: 92.398 ± 0.002°
• γ: 101.789 ± 0.002°
• Cell volume: 1265.5 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0452
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.123
• Weighted residual factors for all reflections included in the refinement: 0.1237
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No