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Information card for entry 2004908
Preview
| Coordinates | 2004908.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | Bis(2-methyl-8-quinolinolato) Molybdenum |
|---|---|
| Formula | C20 H16 Mo N2 O4 |
| Calculated formula | C20 H16 Mo N2 O4 |
| SMILES | [Mo]12([n]3c(ccc4cccc(O1)c34)C)([n]1c(ccc3cccc(O2)c13)C)(=O)=O |
| Title of publication | <i>cis</i>-Bis(2-methyl-8-quinolinolato-<i>N</i>,<i>O</i>)dioxomolybdenum(VI) |
| Authors of publication | Fun, H.-K.; Sivakumar, K.; Niu, J.-Y.; Wang, J.-P.; You, X.-Z. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1996 |
| Journal volume | 52 |
| Journal issue | 5 |
| Pages of publication | 1150 - 1152 |
| a | 13.3698 ± 0.0002 Å |
| b | 8.5803 ± 0.0001 Å |
| c | 16.5573 ± 0.0001 Å |
| α | 90° |
| β | 109.459 ± 0.001° |
| γ | 90° |
| Cell volume | 1790.91 ± 0.04 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0238 |
| Residual factor for significantly intense reflections | 0.0229 |
| Weighted residual factors for all reflections | 0.0556 |
| Weighted residual factors for significantly intense reflections | 0.0552 |
| Goodness-of-fit parameter for all reflections | 1.143 |
| Goodness-of-fit parameter for significantly intense reflections | 1.144 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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