Information card for entry 7037795

Structure parameters

• Formula: C33 H33 N3 O9 Pr
• Calculated formula: C30 H26 N2 O8 Pr
• Title of publication: Rare earth anthracenedicarboxylate metal-organic frameworks: slow relaxation of magnetization of Nd(3+), Gd(3+), Dy(3+), Er(3+) and Yb(3+) based materials.
• Authors of publication: Calahorro, Antonio J.; Oyarzabal, Itziar; Fernández, Belén; Seco, José M; Tian, Tian; Fairen-Jimenez, David; Colacio, Enrique; Rodríguez-Diéguez, Antonio
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 45
• Journal issue: 2
• Pages of publication: 591 - 598
• a: 10.4477 ± 0.0006 Å
• b: 11.4945 ± 0.0007 Å
• c: 12.9583 ± 0.0007 Å
• α: 106.639 ± 0.002°
• β: 90.322 ± 0.002°
• γ: 93.194 ± 0.002°
• Cell volume: 1488.32 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.081
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.0943
• Weighted residual factors for all reflections included in the refinement: 0.1027
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No