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Information card for entry 7000820
Preview
| Coordinates | 7000820.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C66 H54 Cl7 N3 P3 Rh |
|---|---|
| Calculated formula | C66 H53 Cl7 N3 P3 Rh |
| SMILES | [Rh]123([P](n4c(C1(c1n([P]2(c2ccccc2)c2ccccc2)c2c(c1C)cccc2)c1n([P]3(c2ccccc2)c2ccccc2)c2c(c1C)cccc2)c(c1c4cccc1)C)(c1ccccc1)c1ccccc1)Cl.ClC(Cl)Cl.ClC(Cl)Cl |
| Title of publication | Synthesis and reactivity of the novel hydride derivative RhHCl(TIMP3) (HTIMP3 = tris[1-(diphenylphosphino)-3-methyl-1H-indol-2-yl]methane) |
| Authors of publication | Ciclosi, Marco; Estevan, Francisco; Lahuerta, Pascual; Passarelli, Vincenzo; Pérez-Prieto, Julia; Sanaú, Mercedes |
| Journal of publication | Dalton Transactions |
| Year of publication | 2009 |
| Journal issue | 13 |
| Pages of publication | 2290 - 2297 |
| a | 45.545 ± 0.006 Å |
| b | 13.74 ± 0.002 Å |
| c | 21.483 ± 0.003 Å |
| α | 90° |
| β | 112.994 ± 0.001° |
| γ | 90° |
| Cell volume | 12376 ± 3 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0956 |
| Residual factor for significantly intense reflections | 0.0678 |
| Weighted residual factors for significantly intense reflections | 0.203 |
| Weighted residual factors for all reflections included in the refinement | 0.223 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.276 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179686 (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 7/00/08. |
7000820.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7000820.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7000820.cif |
| 1143 | 2010-05-03 | cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition. |
7000820.cif |
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