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Information card for entry 2243921
Preview
| Coordinates | 2243921.cif |
|---|---|
| Structure factors | 2243921.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[μ~3~-aqua-hexa-μ~2~-aqua-tetra-μ-cyanurato-tetralithium] |
|---|---|
| Formula | C12 H22 Li4 N12 O19 |
| Calculated formula | C12 H22 Li4 N12 O19 |
| Title of publication | Polymeric coordination complex of lithium(I) with aqua and cyanurate ligands |
| Authors of publication | Ponnuvel, Anjapuli; Kala, Arumugam Pillai; Nagaraja, Karachalacherevu Seetharamiah; Karnan, Chandran |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2021 |
| Journal volume | 77 |
| Journal issue | 10 |
| a | 8.853 ± 0.0005 Å |
| b | 9.0592 ± 0.0006 Å |
| c | 9.6621 ± 0.0006 Å |
| α | 67.806 ± 0.002° |
| β | 62.887 ± 0.002° |
| γ | 68.58 ± 0.002° |
| Cell volume | 620.88 ± 0.07 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 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 | 0.0443 |
| Residual factor for significantly intense reflections | 0.0391 |
| Weighted residual factors for significantly intense reflections | 0.1097 |
| Weighted residual factors for all reflections included in the refinement | 0.1152 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.14 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269150 (current) | 2021-09-15 | cif/ hkl/ Adding structures of 2243921 via cif-deposit CGI script. |
2243921.cif 2243921.hkl |
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