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Information card for entry 4072099
Preview
| Coordinates | 4072099.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C60 H44 N4 P2 Pt |
|---|---|
| Calculated formula | C60 H44 N4 P2 Pt |
| SMILES | [Pt]([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)(C#Cc1cnc(cc1)c1ncccc1)C#Cc1cnc(cc1)c1ncccc1 |
| Title of publication | Preparation, Characterization, and Photophysical Properties ofcis- ortrans-PtLn2(Ln = Nd, Eu, Yb) Arrays with 5-Ethynyl-2,2′-bipyridine |
| Authors of publication | Xu, Hai-Bing; Ni, Jun; Chen, Kun-Jiao; Zhang, Li-Yi; Chen, Zhong-Ning |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 21 |
| Pages of publication | 5665 |
| a | 11.1503 ± 0.0002 Å |
| b | 15.0906 ± 0.0001 Å |
| c | 15.5381 ± 0.0003 Å |
| α | 74.182 ± 0.006° |
| β | 83.504 ± 0.007° |
| γ | 72.694 ± 0.004° |
| Cell volume | 2400.17 ± 0.11 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 | 0.0408 |
| Residual factor for significantly intense reflections | 0.0344 |
| Weighted residual factors for significantly intense reflections | 0.0741 |
| Weighted residual factors for all reflections included in the refinement | 0.0777 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178609 (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 4/07/20. |
4072099.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4072099.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4072099.cif |
| 44236 | 2012-03-15 | ../uploads/cif-deposit/cod/cif Adding structures of 4072099, 4072100, 4072101 via cif-deposit CGI script. |
4072099.cif |
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