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Information card for entry 7009451
Preview
| Coordinates | 7009451.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H18 As Mo2 O4 P |
|---|---|
| Calculated formula | C16 H18 As Mo2 O4 P |
| SMILES | [Mo]12345([As]([Mo]6789([PH2]1)(C#[O])(C#[O])[cH]1[cH]6[cH]7[cH]8[cH]91)(C)C)(C#[O])(C#[O])[cH]1[cH]2[cH]3[cH]4[cH]51 |
| Title of publication | The reactions of the anions [Cp2(CO)4Mo2(μ-PRR')]− (R, R' = H, Ph) towards chloroarsines and chlorophosphines; synthesis of complexes containing both bridging phosphido and arsenido groups |
| Authors of publication | Davies, John E.; Feeder, Neil; Gray, Caspar A.; Mays, Martin J.; Woods, Anthony D. |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2000 |
| Journal issue | 11 |
| Pages of publication | 1695 |
| a | 10.945 ± 0.004 Å |
| b | 21.547 ± 0.006 Å |
| c | 8.022 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1891.8 ± 1.5 Å3 |
| Cell temperature | 180 ± 2 K |
| Ambient diffraction temperature | 180 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.1658 |
| Residual factor for significantly intense reflections | 0.0811 |
| Weighted residual factors for significantly intense reflections | 0.1645 |
| Weighted residual factors for all reflections included in the refinement | 0.2039 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179798 (current) | 2016-03-25 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/94. |
7009451.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7009451.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7009451.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7009451.cif |
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Users of the data should acknowledge the original authors of the
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