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Information card for entry 8000123
Preview
| Coordinates | 8000123.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C37 H30 Cl4 N2 O4 P Re |
|---|---|
| Calculated formula | C37 H30 Cl4 N2 O4 P Re |
| SMILES | [Re]12([P](c3ccccc3)(c3ccccc3)c3ccccc3)(=O)(Oc3c(Cl)c(Cl)c(Cl)c(Cl)c3O1)[n]1c(ccc3cccc(N2)c13)C.O=C(C)C |
| Title of publication | Oxygen Atom Transfer Catalytic Property of Oxorhenium(V) Complex with 2-Methylquinolin-8-ylamide and Tetrachlorocatecholate |
| Authors of publication | Ohashi, Tetuya; Miyashita, Yoshitaro; Fujisawa, Kiyoshi; Okamoto, Ken-ichi |
| Journal of publication | Chemistry Letters |
| Year of publication | 2006 |
| Journal volume | 35 |
| Journal issue | 6 |
| Pages of publication | 664 |
| a | 9.244 ± 0.003 Å |
| b | 11.851 ± 0.003 Å |
| c | 17.204 ± 0.005 Å |
| α | 77.653 ± 0.005° |
| β | 84.442 ± 0.008° |
| γ | 84.711 ± 0.007° |
| Cell volume | 1827.5 ± 0.9 Å3 |
| Cell temperature | 293.1 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 significantly intense reflections | 0.034 |
| Weighted residual factors for all reflections included in the refinement | 0.099 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.955 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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