Information card for entry 7056751

Structure parameters

• Chemical name: Poly{[diaquatris(mu4-perylene-3,4,9,10-tetracarboxylato)-eicosakis(dimethylformamide)tetradysprosium] tetrahydrate tetrakis(dimethylformamide)}
• Formula: C60 H99 Dy2 N12 O33 S6
• Calculated formula: C55.5 H84.5 Dy2 N10.5 O29.5 S6
• Title of publication: Slow relaxation of magnetization and luminescence properties of a novel dysprosium and pyrene-1,3,6,8-tetrasulfonate based MOF
• Authors of publication: García-García, Amalia; Oyarzabal, Itziar; Cepeda, Javier; Seco, José M.; García-Valdivia, Antonio A.; Gómez-Ruiz, Santiago; Salinas-Castillo, Alfonso; Choquesillo-Lazarte, Duane; Rodríguez-Diéguez, Antonio
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 2
• Pages of publication: 832
• a: 14.162 ± 0.001 Å
• b: 38.224 ± 0.003 Å
• c: 14.065 ± 0.0011 Å
• α: 90°
• β: 94.915 ± 0.002°
• γ: 90°
• Cell volume: 7585.8 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0607
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1316
• Weighted residual factors for all reflections included in the refinement: 0.1374
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No