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Information card for entry 7000590
Preview
| Coordinates | 7000590.cif | 
|---|---|
| Original paper (by DOI) | HTML | 
| Formula | C45 H45 P2 Rh | 
|---|---|
| Calculated formula | C45 H45 P2 Rh | 
| SMILES | [Rh]1234([P](c5ccccc5)(c5ccccc5)C#CC(C)(C)C)([P](c5ccccc5)(c5ccccc5)C#CC(C)(C)C)[cH]5[cH]1[cH]2[c]13[c]45cccc1 | 
| 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 | 11.06 ± 0.0006 Å | 
| b | 11.8418 ± 0.0007 Å | 
| c | 17.1608 ± 0.001 Å | 
| α | 108.854 ± 0.001° | 
| β | 92.464 ± 0.001° | 
| γ | 112.489 ± 0.001° | 
| Cell volume | 1929.21 ± 0.19 Å3 | 
| Cell temperature | 198 ± 1 K | 
| Ambient diffraction temperature | 198 ± 1 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 | 0.0402 | 
| Residual factor for significantly intense reflections | 0.0332 | 
| Weighted residual factors for significantly intense reflections | 0.0877 | 
| Weighted residual factors for all reflections included in the refinement | 0.0922 | 
| Goodness-of-fit parameter for all reflections included in the refinement | 1.091 | 
| Diffraction radiation probe | x-ray | 
| Diffraction radiation wavelength | 0.71073 Å | 
| Diffraction radiation type | MoKα | 
| Has coordinates | Yes | 
| Has disorder | No | 
| Has Fobs | No | 
| Revision | Date | Message | Files | 
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.  | 
	7000590.cif | 
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7000590.cif | 
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7000590.cif | 
| 1143 | 2010-05-03 | cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.  | 
	7000590.cif | 
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          Users of the data should acknowledge the original authors of the
          structural data.