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Information card for entry 7205058
Preview
| Coordinates | 7205058.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H12 Cu Mo4 N6 O14 |
|---|---|
| Calculated formula | C12 H12 Cu Mo4 N6 O14 |
| Title of publication | Unprecedented cyclic [Mo6O19]2− cluster and five organic‒inorganic hybrids based on polyoxomolybdates and 4-amino-3,5-bis(pyridyl)-1,2,4-triazole |
| Authors of publication | Li, Ming-Xing; Chen, Hui-Ling; Geng, Jin-Peng; He, Xiang; Shao, Min; Zhu, Shou-Rong; Wang, Zhao-Xi |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 5 |
| Pages of publication | 1687 |
| a | 7.663 ± 0.0004 Å |
| b | 29.474 ± 0.0017 Å |
| c | 9.7421 ± 0.0006 Å |
| α | 90° |
| β | 101.823 ± 0.001° |
| γ | 90° |
| Cell volume | 2153.7 ± 0.2 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0231 |
| Residual factor for significantly intense reflections | 0.021 |
| Weighted residual factors for significantly intense reflections | 0.0482 |
| Weighted residual factors for all reflections included in the refinement | 0.049 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180381 (current) | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/50. |
7205058.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7205058.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7205058.cif |
| 14539 | 2011-03-11 | ../uploads/cif-deposit/cod/cif Adding structures of 7205056, 7205057, 7205058, 7205059, 7205060 via cif-deposit CGI script. |
7205058.cif |
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Users of the data should acknowledge the original authors of the
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