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Information card for entry 1518522
Preview
| Coordinates | 1518522.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C108 H73 Au6 F18 Mo12 O42 P7 |
|---|---|
| Calculated formula | C108 H64.5 Au6 F18 Mo12 O42 P7 |
| SMILES | [Au]12([Au]([P](c3cc(F)ccc3)(c3cc(F)ccc3)c3cc(F)ccc3)[O]2([Au][P](c2cc(F)ccc2)(c2cc(F)ccc2)c2cc(F)ccc2)[Au]1[P](c1cc(F)ccc1)(c1cc(F)ccc1)c1cc(F)ccc1)[P](c1cc(F)ccc1)(c1cc(F)ccc1)c1cc(F)ccc1.[Au]([P](c1cc(F)ccc1)(c1cc(F)ccc1)c1cc(F)ccc1)O[Au][P](c1cc(F)ccc1)(c1cc(F)ccc1)c1cc(F)ccc1.[Mo]1234(=O)O[Mo]567(=O)O[Mo]89(=O)(O1)O[Mo]1%10%11(=O)O[Mo]%12%13(=O)(O[Mo]%14%15(=O)(O1)O[Mo]1%16%17(=O)O[Mo]%18%19(=O)(O[Mo](=O)(O1)(O5)(O%12)[O]7%13=P15[O]4%19[Mo]4(=O)(O[Mo](=O)(O[Mo](=O)(O4)(O%14)(O%16)[O]5%15%17)(O8)(O%10)[O]19%11)(O3)O%18)O2)O6 |
| Title of publication | Various Oxygen-Centered Phosphanegold(I) Cluster Cations Formed by Polyoxometalate (POM)-Mediated Clusterization: Effects of POMs and Phosphanes |
| Authors of publication | Yoshida, Takuya; Yasuda, Yuta; Nagashima, Eri; Arai, Hidekazu; Matsunaga, Satoshi; Nomiya, Kenji |
| Journal of publication | Inorganics |
| Year of publication | 2014 |
| Journal volume | 2 |
| Journal issue | 4 |
| Pages of publication | 660 |
| a | 16.191 ± 0.002 Å |
| b | 29.165 ± 0.004 Å |
| c | 35.365 ± 0.004 Å |
| α | 99.801 ± 0.002° |
| β | 99.153 ± 0.002° |
| γ | 104.963 ± 0.002° |
| Cell volume | 15532 ± 3 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1077 |
| Residual factor for significantly intense reflections | 0.0723 |
| Weighted residual factors for significantly intense reflections | 0.1625 |
| Weighted residual factors for all reflections included in the refinement | 0.1753 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 217633 (current) | 2019-08-21 | cif/1: Fixing Z values and formulae |
1518522.cif |
| 176729 | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1518522.cif |
| 129335 | 2015-01-03 | cif/ Adding structures of 1518522 via cif-deposit CGI script. |
1518522.cif |
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Users of the data should acknowledge the original authors of the
structural data.