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Information card for entry 4327469
Preview
| Coordinates | 4327469.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Chloro[6-(ortho-phenylene)-2,2'-bipyridine-κC,κN,κN]platinum(II) red modification |
|---|---|
| Formula | C16 H11 Cl N2 Pt |
| Calculated formula | C16 H11 Cl N2 Pt |
| SMILES | [Pt]12([n]3c(c4[n]1cccc4)cccc3c1ccccc21)Cl |
| Title of publication | Cyclometalated Analogues of Platinum Terpyridine Complexes: Kinetic Study of the Strong σ-Donor Cis and Trans Effects of Carbon in the Presence of a π-Acceptor Ligand Backbone |
| Authors of publication | Andreas Hofmann; Lutz Dahlenburg; Rudi van Eldik |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2003 |
| Journal volume | 42 |
| Pages of publication | 6528 - 6538 |
| a | 8.88 ± 0.005 Å |
| b | 12.336 ± 0.005 Å |
| c | 13.624 ± 0.003 Å |
| α | 102.1 ± 0.03° |
| β | 102.13 ± 0.03° |
| γ | 104.07 ± 0.04° |
| Cell volume | 1360.8 ± 1.1 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0705 |
| Residual factor for significantly intense reflections | 0.0494 |
| Weighted residual factors for significantly intense reflections | 0.1216 |
| Weighted residual factors for all reflections included in the refinement | 0.1335 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
| 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 |
|---|---|---|---|
| 179377 (current) | 2016-03-23 | cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/74. |
4327469.cif |
| 120105 | 2014-07-12 | Adding DOIs to range 4/32 structures. | 4327469.cif |
| 61279 | 2012-06-26 | cif/4 Fixing wrong year of publication of several entries (there was a mistake when these files were deposited) |
4327469.cif |
| 61240 | 2012-06-25 | cif/ Adding structures of 4327469 via cif-deposit CGI script. |
4327469.cif |
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Users of the data should acknowledge the original authors of the
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