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Information card for entry 7111363
Preview
| Coordinates | 7111363.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H13 F16 P Pt S3 |
|---|---|
| Calculated formula | C36 H13 F16 P Pt S3 |
| SMILES | [Pt]1([P](c2c([S]1c1c(F)c(F)cc(F)c1F)c(c(c(c2F)F)F)F)(c1ccccc1)c1ccccc1)(Sc1c(F)c(F)cc(F)c1F)Sc1c(F)c(F)cc(F)c1F |
| Title of publication | Conversion of [Pt(SRf)2(PPh2 ? n(C6F5)n + 1)2] ( n = 0 or 1, Rf?C6HF4-4) through carbon?fluorine bond activation to [Pt(SRf)2(1,2-C6F4(SRf)-(PPh2))] and chiral [Pt(SRf)2(1,2-C6F4(SRf)(PPh(C6F5)))]Electronic Supplementary Information (ESI) available: experimental procedures and spectral data for all new compounds and crystallographic data for 5, 8 and 10. http://www.rsc.org/suppdata/cc/b4/b407328b/ |
| Authors of publication | Villanueva, Luis; Arroyo, Maribel; Bern�s, Sylvain; Torrens, Hugo |
| Journal of publication | Chemical Communications |
| Year of publication | 2004 |
| Journal issue | 17 |
| Pages of publication | 1942 - 1943 |
| a | 11.945 ± 0.003 Å |
| b | 12.0754 ± 0.0014 Å |
| c | 13.4898 ± 0.0018 Å |
| α | 102.108 ± 0.01° |
| β | 102.397 ± 0.017° |
| γ | 105.499 ± 0.014° |
| Cell volume | 1756 ± 0.6 Å3 |
| Cell temperature | 293 ± 1 K |
| Ambient diffraction temperature | 293 ± 1 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0713 |
| Residual factor for significantly intense reflections | 0.0431 |
| Weighted residual factors for significantly intense reflections | 0.0807 |
| Weighted residual factors for all reflections included in the refinement | 0.1023 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.167 |
| 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 |
|---|---|---|---|
| 180227 (current) | 2016-03-26 | cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/13. |
7111363.cif |
| 96458 | 2014-01-29 | cif/ Adding structures of 7111362, 7111363, 7111364 via cif-deposit CGI script. |
7111363.cif |
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