Information card for entry 7715822

Structure parameters

• Formula: C36 H37 Co N11 O2.5 P S3
• Calculated formula: C36 H34.25 Co N11 O2.5 P S3
• Title of publication: Control of the geometry and anisotropy driven by the combination of steric and anion coordination effects in CoII complexes with N6-tripodal ligands: The impact of the size of the ligand on the magnetization relaxation time
• Authors of publication: Landart Gereka, Aritz; Quesada-Moreno, María Mar; Palacios, Maria A.; Li, Yanling; Ozerov, Mykhaylo; Krzystek, Jurek; Colacio, Enrique
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 27.919 ± 0.003 Å
• b: 13.9992 ± 0.0013 Å
• c: 20.96 ± 0.002 Å
• α: 90°
• β: 107.188 ± 0.003°
• γ: 90°
• Cell volume: 7826.2 ± 1.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0627
• Residual factor for significantly intense reflections: 0.0511
• Weighted residual factors for significantly intense reflections: 0.1231
• Weighted residual factors for all reflections included in the refinement: 0.1292
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No