Information card for entry 7714963

Structure parameters

• Formula: C32 H26 Co N10 O4 S2
• Calculated formula: C32 H26 Co N10 O4 S2
• SMILES: [Co]123([n]4c(N1S(=O)(=O)c1ccc(N)cc1)nccc4)([n]1c(N2S(=O)(=O)c2ccc(N)cc2)nccc1)[n]1cccc2c1c1[n]3cccc1cc2
• Title of publication: Spin canting and slow magnetic relaxation in mononuclear cobalt(II) sulfadiazine ternary complexes.
• Authors of publication: Villa-Pérez, Cristian; Zabala-Lekuona, Andoni; Vitorica-Yrezabal, Iñigo J; Seco, José Manuel; Cepeda, Javier; Echeverría, Gustavo Alberto; Soria, Delia Beatriz
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 7
• Pages of publication: 3254 - 3266
• a: 11.1595 ± 0.0007 Å
• b: 17.8542 ± 0.0011 Å
• c: 16.0849 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3204.8 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0927
• Residual factor for significantly intense reflections: 0.0523
• Weighted residual factors for significantly intense reflections: 0.0884
• Weighted residual factors for all reflections included in the refinement: 0.1054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No