Information card for entry 7233508

Structure parameters

• Chemical name: Tris(2,6-dimethyl-3,5-heptanedionate)mono(5-nitro- 1,10-phenanthroline)erbium(III)
• Formula: C39 H52 Er N3 O8
• Calculated formula: C39 H52 Er N3 O8
• Title of publication: Novel erbium(III) complexes with 2,6-dimethyl-3,5-heptanedione and different N,N-donor ligands for ormosil and PMMA matrices doping
• Authors of publication: P. Martin-Ramos; V. Lavin; M. Ramos Silva; I. R. Martin; F. Lahoz; P. Chamorro-Posada; J. A. Paixao; J. Martin-Gil
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2013
• Journal volume: 1
• Pages of publication: 5701 - 5710
• a: 13.7978 ± 0.0009 Å
• b: 17.4765 ± 0.0012 Å
• c: 26.166 ± 0.0017 Å
• α: 83.044 ± 0.005°
• β: 79.39 ± 0.005°
• γ: 88.249 ± 0.005°
• Cell volume: 6155.9 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.2784
• Residual factor for significantly intense reflections: 0.0812
• Weighted residual factors for significantly intense reflections: 0.1535
• Weighted residual factors for all reflections included in the refinement: 0.219
• Goodness-of-fit parameter for all reflections included in the refinement: 0.938
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No