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Information card for entry 4507852
Preview
| Coordinates | 4507852.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H22 N2 O15 U |
|---|---|
| Calculated formula | C8 H22 N2 O15 U |
| Title of publication | Two Systems of [DabcoH2]2+/[PipH2]2±-Uranyl‒Oxalate Showing Reversible Crystal-to-Crystal Transformations Controlled by the Diammonium/Uranyl/Oxalate Ratios in Aqueous Solutions ([DabcoH2]2+= 1,4-Diazabicyclo-[2.2.2]-octaneH2and [PipH2]2+= PiperazineH2) |
| Authors of publication | Wang, Lu-Hua; Shang, Ran; Zheng, Zhong; Liu, Chun-Li; Wang, Zhe-Ming |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2013 |
| Journal volume | 13 |
| Journal issue | 6 |
| Pages of publication | 2597 |
| a | 7.6069 ± 0.0003 Å |
| b | 7.8388 ± 0.0003 Å |
| c | 16.1897 ± 0.0007 Å |
| α | 79.005 ± 0.001° |
| β | 80.984 ± 0.001° |
| γ | 79.579 ± 0.002° |
| Cell volume | 924.53 ± 0.06 Å3 |
| Cell temperature | 180 K |
| Ambient diffraction temperature | 180 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 | 0.0554 |
| Residual factor for significantly intense reflections | 0.0419 |
| Weighted residual factors for significantly intense reflections | 0.0917 |
| Weighted residual factors for all reflections included in the refinement | 0.0959 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179614 (current) | 2016-03-24 | cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/78. |
4507852.cif |
| 87121 | 2013-07-14 | cif/ Adding structures of 4507849, 4507850, 4507851, 4507852, 4507853 via cif-deposit CGI script. |
4507852.cif |
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Users of the data should acknowledge the original authors of the
structural data.