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Information card for entry 4070579
Preview
| Coordinates | 4070579.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | ChemSpider |
| Formula | C32 H32 N4 Pt S4 |
|---|---|
| Calculated formula | C32 H32 N4 Pt S4 |
| SMILES | [Pt]12([n]3c(c4cc(C(C)(C)C)cc[n]14)cc(C(C)(C)C)cc3)SC1=C(S2)SC(=C(c2ccccn2)c2ccccn2)S1 |
| Title of publication | Syntheses, Structures, and Properties of Tricarbonyl Rhenium(I) Heteronuclear Complexes with a New Bridging Ligand Containing Coupled Bis(2-pyridyl) and 1,2-Dithiolene Units |
| Authors of publication | Liu, Wei; Wang, Ru; Zhou, Xin-Hui; Zuo, Jing-Lin; You, Xiao-Zeng |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 1 |
| Pages of publication | 126 |
| a | 18.866 ± 0.005 Å |
| b | 10.91 ± 0.003 Å |
| c | 15.82 ± 0.004 Å |
| α | 90° |
| β | 104.639 ± 0.005° |
| γ | 90° |
| Cell volume | 3150.5 ± 1.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0909 |
| Residual factor for significantly intense reflections | 0.0642 |
| Weighted residual factors for significantly intense reflections | 0.1604 |
| Weighted residual factors for all reflections included in the refinement | 0.17 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.988 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 201982 (current) | 2017-10-13 | cif/ Marking COD entries in range 4 that are known to be related to ChemSpider entries using the _cod_related_entry data loop. |
4070579.cif |
| 178594 | 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 4/07/05. |
4070579.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4070579.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070579.cif |
| 42575 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4070579 via cif-deposit CGI script. |
4070579.cif |
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Users of the data should acknowledge the original authors of the
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