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Information card for entry 4072421
Preview
| Coordinates | 4072421.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C56 H56 Cl8 N4 Pt2 |
|---|---|
| Calculated formula | C56 H56 Cl8 N4 Pt2 |
| SMILES | c1ccc2cc(cc3c2[n]1[Pt]1([n]2cccc4cc(cc(c24)c2c[c]45c6cc(cc7ccc[n](c67)[Pt]5([n]5cccc6cc(cc(c56)c4c[c]312)CC)(C)(C)Cl)CC)CC)(C)(C)Cl)CC.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl |
| Title of publication | Diplatinum Complexes Supported by Novel Tetradentate Ligands with Quinoline Functionalities for Tandem C−Cl Activation and Dearomatization |
| Authors of publication | Tan, Runyu; Jia, Peng; Rao, Yingli; Jia, Wenli; Hadzovic, Alen; Yu, Qing; Li, Xia; Song, Datong |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 24 |
| Pages of publication | 6614 |
| a | 9.3132 ± 0.0004 Å |
| b | 11.8742 ± 0.0004 Å |
| c | 13.3219 ± 0.0003 Å |
| α | 67.5142 ± 0.0017° |
| β | 85.269 ± 0.002° |
| γ | 85.9551 ± 0.0017° |
| Cell volume | 1355.37 ± 0.08 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.0455 |
| Residual factor for significantly intense reflections | 0.0389 |
| Weighted residual factors for significantly intense reflections | 0.0964 |
| Weighted residual factors for all reflections included in the refinement | 0.1011 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178613 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/24. |
4072421.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4072421.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4072421.cif |
| 44413 | 2012-03-15 | ../uploads/cif-deposit/cod/cif Adding structures of 4072413, 4072414, 4072415, 4072416, 4072417, 4072418, 4072419, 4072420, 4072421, 4072422, 4072423 via cif-deposit CGI script. |
4072421.cif |
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