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Information card for entry 4070055
Preview
| Coordinates | 4070055.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C35 H32 I2 O3 P2 Pt |
|---|---|
| Calculated formula | C35 H32 I2 O3 P2 Pt |
| SMILES | [Pt]1(I)(I)[P@@]2(c3ccccc3)[C@@H]3C(=C(C)[C@H]2[C@@]2([C@H]3O[C@H](C2)OC(=O)c2ccccc2)[P]1(c1ccccc1)c1ccccc1)C |
| Title of publication | Enantioselective Diels−Alder Reaction of 3-Diphenylphosphinofuran with 1-Phenyl-3,4-dimethylphosphole and Subsequent Synthetic Manipulations of the Cycloadduct |
| Authors of publication | Liu, Fengli; Pullarkat, Sumod A.; Tan, Kien-Wee; Li, Yongxin; Leung, Pak-Hing |
| Journal of publication | Organometallics |
| Year of publication | 2009 |
| Journal volume | 28 |
| Journal issue | 21 |
| Pages of publication | 6254 |
| a | 12.3171 ± 0.0002 Å |
| b | 14.4668 ± 0.0002 Å |
| c | 18.6833 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3329.16 ± 0.09 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0407 |
| Residual factor for significantly intense reflections | 0.0293 |
| Weighted residual factors for significantly intense reflections | 0.0637 |
| Weighted residual factors for all reflections included in the refinement | 0.0826 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178589 (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 4/07/00. |
4070055.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4070055.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070055.cif |
| 40580 | 2012-03-08 | ../uploads/cif-deposit/cod/cif Adding structures of 4070052, 4070053, 4070054, 4070055 via cif-deposit CGI script. |
4070055.cif |
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