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Information card for entry 7011369
Preview
| Coordinates | 7011369.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C55 H46 Cl2 N4 O2 P2 Pt |
|---|---|
| Calculated formula | C55 H46 Cl2 N4 O2 P2 Pt |
| SMILES | [Pt]12(N(C(=C[P]1(c1ccccc1)c1ccccc1)c1ccccc1)N=C(c1ccccc1)O2)[P](c1ccccc1)(c1ccccc1)C/C(=N\NC(=O)c1ccccc1)c1ccccc1.C(Cl)Cl |
| Title of publication | Uni-, bi- and ter-dentate complexes formed from PPh2CH2C(R)NNHC(O)Ph (R = But or Ph) and Pd or Pt: crystal structures of [PdCl{PPh2CH2C(But)NNC(Ph)O}], [Pt{PPh2CHC(Ph)NNC(Ph)O}{PPh2CH2C(Ph)NNHC(O)Ph}] and [Pd{PPh2CHC(But)NHNC(O)Ph}2] |
| Authors of publication | Ahmad, Mustaffa; Perera, Sarath D.; Shaw, Bernard L.; Thornton-Pett, Mark |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2002 |
| Journal issue | 9 |
| Pages of publication | 1954 |
| a | 12.614 ± 0.002 Å |
| b | 13.671 ± 0.002 Å |
| c | 15.754 ± 0.003 Å |
| α | 100.26 ± 0.009° |
| β | 99.334 ± 0.009° |
| γ | 110.682 ± 0.007° |
| Cell volume | 2425.1 ± 0.7 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0258 |
| Residual factor for significantly intense reflections | 0.0221 |
| Weighted residual factors for significantly intense reflections | 0.0536 |
| Weighted residual factors for all reflections included in the refinement | 0.0558 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213973 (current) | 2019-03-05 | cod/ Removed potentially copyrighted or irrelevant data items from 1289 entries. |
7011369.cif |
| 179817 | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/13. |
7011369.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7011369.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7011369.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7011369.cif |
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