Information card for entry 7715717

Structure parameters

• Chemical name: H4L
• Formula: C46 H64 N4 O8
• Calculated formula: C46 H64 N4 O8
• Title of publication: From field-induced to zero-field SMMs associated with open/closed structures of bis(ZnDy) tetranuclear complexes: a combined magnetic, theoretical and optical study
• Authors of publication: Zabala-Lekuona, Andoni; Lopez de Pariza, Xabier; Díaz-Ortega, Ismael Francisco; Cepeda, Javier; Nojiri, Hiroyuki; Gritsan, Nina P.; Dmitriev, A. A.; López-Ortega, Alberto; Rodríguez Diéguez, Antonio; Seco, José Manuel; Colacio, Enrique
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 7.7203 ± 0.0004 Å
• b: 11.3727 ± 0.0005 Å
• c: 12.608 ± 0.0006 Å
• α: 91.3198 ± 0.0017°
• β: 103.034 ± 0.0016°
• γ: 100.541 ± 0.0018°
• Cell volume: 1057.88 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0852
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1347
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No