Information card for entry 7716577

Structure parameters

• Formula: C94 H128 Co2 N16 O4
• Calculated formula: C94 H128 Co2 N16 O4
• Title of publication: Magnetic anisotropy and slow relaxation of magnetisation in double salts containing four- and six-coordinate cobalt(II) complex ions.
• Authors of publication: Juráková, Jana; Santana, Vinicius Tadeu; Pavlik, Ján; Moncoľ, Ján; Nemec, Ivan; Clemente-León, Miguel; Kuppusamy, Senthil Kumar; Ruben, Mario; Čižmár, Erik; Šalitroš, Ivan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 31
• Pages of publication: 12962 - 12972
• a: 19.8535 ± 0.0006 Å
• b: 27.2121 ± 0.0005 Å
• c: 18.7151 ± 0.0004 Å
• α: 90°
• β: 113.315 ± 0.003°
• γ: 90°
• Cell volume: 9285.3 ± 0.4 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: 0.1267
• Residual factor for significantly intense reflections: 0.1086
• Weighted residual factors for significantly intense reflections: 0.2926
• Weighted residual factors for all reflections included in the refinement: 0.3057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No