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Information card for entry 4511738
Preview
| Coordinates | 4511738.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H4 Li2 O8 |
|---|---|
| Calculated formula | C10 H4 Li2 O8 |
| SMILES | C(=O)(O)c1cc(c(C(=O)O)cc1C(=O)[O-])C(=O)[O-].[Li+].[Li+] |
| Title of publication | Syntheses and Structural Characterization of Lithium Carboxylate Frameworks and Guest-Dependent Photoluminescence Study |
| Authors of publication | Aliev, Sokhrab B.; Samsonenko, Denis G.; Rakhmanova, Mariana I.; Dybtsev, Danil N.; Fedin, Vladimir P. |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2014 |
| Journal volume | 14 |
| Journal issue | 9 |
| Pages of publication | 4355 |
| a | 5.0422 ± 0.0003 Å |
| b | 7.1471 ± 0.0005 Å |
| c | 7.2031 ± 0.0005 Å |
| α | 83.237 ± 0.002° |
| β | 76.586 ± 0.002° |
| γ | 81.731 ± 0.002° |
| Cell volume | 248.91 ± 0.03 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0374 |
| Residual factor for significantly intense reflections | 0.0319 |
| Weighted residual factors for significantly intense reflections | 0.084 |
| Weighted residual factors for all reflections included in the refinement | 0.0884 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179664 (current) | 2016-03-24 | cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/17. |
4511738.cif |
| 122868 | 2014-09-06 | cif/ Updating files of 4511737, 4511738, 4511739, 4511740, 4511741 Original log message: Adding full bibliography for 4511737--4511741.cif. |
4511738.cif |
| 121004 | 2014-08-01 | cif/ Adding structures of 4511737, 4511738, 4511739, 4511740, 4511741 via cif-deposit CGI script. |
4511738.cif |
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Users of the data should acknowledge the original authors of the
structural data.