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Information card for entry 7055712
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Coordinates | 7055712.cif |
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Original paper (by DOI) | HTML |
Chemical name | Hexa(2,4-nonanedionate)(2,2'-bipyrimidine)di-erbium(III) |
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Formula | C31 H48 Er N2 O6 |
Calculated formula | C31 H48 Er N2 O6 |
Title of publication | Structure, luminescence and magnetic properties of an erbium(iii) β-diketonate homodinuclear complex |
Authors of publication | Martín-Ramos, P.; Pereira, L. C. J.; Coutinho, J. T.; Koprowiak, F.; Bolvin, H.; Lavín, V.; Martín, I. R.; Martín-Gil, J.; Silva, M. Ramos |
Journal of publication | New J. Chem. |
Year of publication | 2016 |
Journal volume | 40 |
Journal issue | 10 |
Pages of publication | 8251 |
a | 16.7455 ± 0.0006 Å |
b | 13.1161 ± 0.0004 Å |
c | 16.7312 ± 0.0006 Å |
α | 90° |
β | 110.758 ± 0.002° |
γ | 90° |
Cell volume | 3436.2 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
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 | 0.1204 |
Residual factor for significantly intense reflections | 0.054 |
Weighted residual factors for significantly intense reflections | 0.1085 |
Weighted residual factors for all reflections included in the refinement | 0.146 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.107 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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