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Information card for entry 7000593
Preview
| Coordinates | 7000593.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | bis(μ~2~-1,2-bis(Diphenylphosphino)ethyne)- bis(η^5^-indenyl)-di-rodium |
|---|---|
| Formula | C70 H54 P4 Rh2 |
| Calculated formula | C70 H54 P4 Rh2 |
| SMILES | [Rh]12345([P](c6ccccc6)(c6ccccc6)C#C[P]([Rh]6789([P](c%10ccccc%10)(c%10ccccc%10)C#C[P]1(c1ccccc1)c1ccccc1)[cH]1[cH]6[cH]7[c]68cccc[c]916)(c1ccccc1)c1ccccc1)[cH]1[cH]2[cH]3[c]24[c]51cccc2 |
| Title of publication | Synthesis and structure of indenyl rhodium(I) complexes containing unsaturated phosphines: catalyst precursors for alkene hydroboration |
| Authors of publication | Garon, Christian N.; McIsaac, Daniel I.; Vogels, Christopher M.; Decken, Andreas; Williams, Ian D.; Kleeberg, Christian; Marder, Todd B.; Westcott, Stephen A. |
| Journal of publication | Dalton Transactions |
| Year of publication | 2009 |
| Journal issue | 9 |
| Pages of publication | 1624 - 1631 |
| a | 11.6644 ± 0.0002 Å |
| b | 13.4814 ± 0.0002 Å |
| c | 19.1415 ± 0.0003 Å |
| α | 102.098 ± 0.0005° |
| β | 92.97 ± 0.0006° |
| γ | 106.469 ± 0.0005° |
| Cell volume | 2802.52 ± 0.08 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0406 |
| Residual factor for significantly intense reflections | 0.0297 |
| Weighted residual factors for significantly intense reflections | 0.0698 |
| Weighted residual factors for all reflections included in the refinement | 0.0757 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179683 (current) | 2016-03-24 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/05. |
7000593.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7000593.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7000593.cif |
| 1143 | 2010-05-03 | cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition. |
7000593.cif |
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