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Information card for entry 7032801
Preview
| Coordinates | 7032801.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C32 H84 Fe4 N8 O52 U2 |
|---|---|
| Calculated formula | C32 H84 Fe4 N8 O52 U2 |
| Title of publication | Structural characterization of environmentally relevant ternary uranyl citrate complexes present in aqueous solutions and solid state materials. |
| Authors of publication | Basile, Madeline; Unruh, Daniel K.; Flores, Erin; Johns, Adam; Forbes, Tori Z. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 6 |
| Pages of publication | 2597 - 2605 |
| a | 11.2951 ± 0.0008 Å |
| b | 11.6508 ± 0.0009 Å |
| c | 14.0541 ± 0.0011 Å |
| α | 77.664 ± 0.003° |
| β | 71.186 ± 0.003° |
| γ | 66.255 ± 0.002° |
| Cell volume | 1595 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0453 |
| Residual factor for significantly intense reflections | 0.0385 |
| Weighted residual factors for significantly intense reflections | 0.0948 |
| Weighted residual factors for all reflections included in the refinement | 0.0981 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.102 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301849 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/03/ Each referenced PubChem compound corresponds to the full crystal structure. |
7032801.cif |
| 180034 | 2016-03-25 | cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/28. |
7032801.cif |
| 133346 | 2015-03-06 | cif/ Updating files of 7032797, 7032798, 7032799, 7032800, 7032801 Original log message: Adding full bibliography for 7032797--7032801.cif. |
7032801.cif |
| 125344 | 2014-10-15 | cif/ Adding structures of 7032797, 7032798, 7032799, 7032800, 7032801 via cif-deposit CGI script. |
7032801.cif |
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Users of the data should acknowledge the original authors of the
structural data.