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Information card for entry 4334262
Preview
| Coordinates | 4334262.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | [Eu(CyMe4-BTBP)2(NO3)](NO3)2.4EtOH.2H2O |
|---|---|
| Formula | C72 H104 Eu N19 O15 |
| Calculated formula | C72 H100 Eu N19 O15 |
| SMILES | C1CC(c2c(C1(C)C)n[n]1c(n2)c2[n]3c(ccc2)c2[n]4c(ccc2)c2[n](nc5c(n2)C(CCC5(C)C)(C)C)[Eu]2567134(ON(=[O]2)=O)[n]1nc2c(C(CCC2(C)C)(C)C)nc1c1[n]5c(ccc1)c1[n]6c(ccc1)c1[n]7nc2c(n1)C(CCC2(C)C)(C)C)(C)C.O=N(=O)[O-].OCC.OCC.O.O=N(=O)[O-].OCC.OCC.O |
| Title of publication | Lanthanide Speciation in Potential SANEX and GANEX Actinide/Lanthanide Separations Using Tetra-N-Donor Extractants |
| Authors of publication | Daniel M. Whittaker; Tamara L. Griffiths; Madeleine Helliwell; Adam N. Swinburne; Louise S. Natrajan; Frank W. Lewis; Laurence M. Harwood; Stephen A. Parry; Clint A. Sharrad |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2013 |
| Journal volume | 52 |
| Pages of publication | 3429 - 3444 |
| a | 16.4128 ± 0.0006 Å |
| b | 23.8916 ± 0.0006 Å |
| c | 19.7838 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 7757.8 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 56 |
| Hermann-Mauguin space group symbol | P c c n |
| Hall space group symbol | -P 2ab 2ac |
| Residual factor for all reflections | 0.1291 |
| Residual factor for significantly intense reflections | 0.1158 |
| Weighted residual factors for significantly intense reflections | 0.2577 |
| Weighted residual factors for all reflections included in the refinement | 0.2628 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.333 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179445 (current) | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/42. |
4334262.cif |
| 100079 | 2014-02-04 | cif/ Adding structures of 4334262 via cif-deposit CGI script. |
4334262.cif |
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