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Information card for entry 4030608
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| Coordinates | 4030608.cif |
|---|
| Formula | C45 H31 Cl17 Mo4 O6 |
|---|---|
| Calculated formula | C45 Cl17 Mo4 O6 |
| SMILES | C1(c2ccccc2)=[O][Mo]2(=O)(Cl)(Cl)[Cl][Mo](O1)(=O)([Cl]2)(Cl)Cl.O=[Mo]12(Cl)([Cl][Mo](=O)([Cl]1)(Cl)([Cl]2)Cl)Cl.c1c(Cl)ccc([C+](c2ccccc2)c2ccc(cc2)Cl)c1.[C+](c1ccccc1)(c1ccc(cc1)Cl)c1ccc(cc1)Cl |
| Title of publication | Synthesis and characterization of a dimolybdenum (V) complex |
| Authors of publication | Wei Qiu; Li Li; Juzheng Liu; Xiaofeng Zheng; Yuguo Fan; Chunting Sun; Qijun Huang; Jingweng Zhang |
| Journal of publication | European Journal of Solid State and Inorganic Chemistry |
| Year of publication | 1993 |
| Journal volume | 30 |
| Pages of publication | 1039 - 1048 |
| a | 16.763 ± 0.003 Å |
| b | 11.142 ± 0.002 Å |
| c | 15.694 ± 0.003 Å |
| α | 90° |
| β | 101.35 ± 0.02° |
| γ | 90° |
| Cell volume | 2873.9 ± 0.9 Å3 |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 5 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for significantly intense reflections | 0.057 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178485 (current) | 2016-03-21 | cif/4/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/03/06. |
4030608.cif |
| 130918 | 2015-02-04 | cif/ Adding structures of 4030608 via cif-deposit CGI script. |
4030608.cif |
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Users of the data should acknowledge the original authors of the
structural data.