Information card for entry 7720247

Structure parameters

• Formula: C13 H8 Cl2 N2 O
• Calculated formula: C13 H8 Cl2 N2 O
• Title of publication: In Medio Stat Virtus: Asymmetric Salphen Metal Complexes with Improved Biological Properties
• Authors of publication: D'Anna, Luisa; Froux, Aurane; Bonsignore, Riccardo; Roller, Alexander; Kowol, Christian R.; Monari, Antonio; Grandemange, Stéphanie; Barone, Giampaolo; Terenzi, Alessio
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 11.7331 ± 0.0009 Å
• b: 7.2792 ± 0.0006 Å
• c: 13.7801 ± 0.0011 Å
• α: 90°
• β: 104.101 ± 0.006°
• γ: 90°
• Cell volume: 1141.46 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.066
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.1461
• Weighted residual factors for all reflections included in the refinement: 0.157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No