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Information card for entry 7013483
Preview
| Coordinates | 7013483.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H32 Cr N2 O2 |
|---|---|
| Calculated formula | C24 H32 Cr N2 O2 |
| SMILES | [n]12c(cccc1C)C=C(O[Cr]12OC(=Cc2[n]1c(ccc2)C)C(C)(C)C)C(C)(C)C |
| Title of publication | Low valent chromium complexes bearing N,O-chelating pyridyl-enolate ligands [OC(Bu^t^)(=2-CHN~5~H~3~Me-x)]^-^ (x = 3-6) |
| Authors of publication | Gibson, Vernon C.; Newton, Claire; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J. |
| Journal of publication | Dalton Transactions |
| Year of publication | 2003 |
| Journal issue | 24 |
| Pages of publication | 4612 - 4617 |
| a | 19.883 ± 0.004 Å |
| b | 10.2348 ± 0.0013 Å |
| c | 11.578 ± 0.002 Å |
| α | 90° |
| β | 93.894 ± 0.015° |
| γ | 90° |
| Cell volume | 2350.7 ± 0.7 Å3 |
| Cell temperature | 183 ± 2 K |
| Ambient diffraction temperature | 183 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0632 |
| Residual factor for significantly intense reflections | 0.0531 |
| Weighted residual factors for all reflections | 0.1518 |
| Weighted residual factors for significantly intense reflections | 0.1418 |
| Goodness-of-fit parameter for all reflections | 1.052 |
| Goodness-of-fit parameter for significantly intense reflections | 1.073 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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