Information card for entry 7063475

Structure parameters

• Formula: C21 H28 Ce N5 Ni O15
• Calculated formula: C21 H28 Ce N5 Ni O15
• 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
• Journal volume: 48
• Journal issue: 41
• Pages of publication: 17750 - 17760
• a: 8.8746 ± 0.0001 Å
• b: 16.048 ± 0.0002 Å
• c: 10.0771 ± 0.0001 Å
• α: 90°
• β: 91.844 ± 0.001°
• γ: 90°
• Cell volume: 1434.43 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0622
• Residual factor for significantly intense reflections: 0.0621
• Weighted residual factors for significantly intense reflections: 0.1577
• Weighted residual factors for all reflections included in the refinement: 0.158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No