Information card for entry 7704613

Structure parameters

• Formula: C47 H39 Cl2 Dy2 N7 O8
• Calculated formula: C47 H39 Cl2 Dy2 N7 O8
• Title of publication: Dysprosium-based complexes with a flat pentadentate donor: a magnetic and ab initio study.
• Authors of publication: Fondo, Matilde; Corredoira-Vázquez, Julio; García-Deibe, Ana M; Gómez-Coca, Silvia; Ruiz, Eliseo; Sanmartín-Matalobos, Jesús
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 24
• Pages of publication: 8389 - 8401
• a: 19.188 ± 0.004 Å
• b: 18.419 ± 0.004 Å
• c: 12.866 ± 0.003 Å
• α: 90°
• β: 102.517 ± 0.007°
• γ: 90°
• Cell volume: 4439.1 ± 1.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.112
• Residual factor for significantly intense reflections: 0.0761
• Weighted residual factors for significantly intense reflections: 0.193
• Weighted residual factors for all reflections included in the refinement: 0.2123
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No