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Information card for entry 4329999
Preview
| Coordinates | 4329999.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H94 Co2 O26 P8 V2 |
|---|---|
| Calculated formula | C58 H94 Co2 O26 P8 V2 |
| SMILES | c1c(cccc1)P1(=[O][V]23(OP(c4ccccc4)(c4ccccc4)=[O][V]45(O1)(=O)O[P]([Co]1678([P](OCC)(OCC)O4)([P](OCC)(OCC)O5)[cH]4[cH]1[cH]6[cH]7[cH]84)(OCC)OCC)(=O)O[P]([Co]1456([P](OCC)(OCC)O2)([P](OCC)(OCC)O3)[cH]2[cH]5[cH]6[cH]1[cH]42)(OCC)OCC)c1ccccc1.O.O |
| Title of publication | Phosph(on/in)ate-Bridged Vanadium(IV) Dimers: Synthesis and Characterization |
| Authors of publication | Alexander E. Anderson; Michael P. Weberski; Craig C. McLauchlan |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2012 |
| Journal volume | 51 |
| Pages of publication | 8719 - 8728 |
| a | 11.7238 ± 0.0007 Å |
| b | 11.8877 ± 0.0007 Å |
| c | 15.238 ± 0.0013 Å |
| α | 96.224 ± 0.001° |
| β | 103.748 ± 0.001° |
| γ | 113.888 ± 0.001° |
| Cell volume | 1835.4 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0395 |
| Residual factor for significantly intense reflections | 0.0313 |
| Weighted residual factors for significantly intense reflections | 0.0796 |
| Weighted residual factors for all reflections included in the refinement | 0.0858 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4329999.html
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Users of the data should acknowledge the original authors of the
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