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Information card for entry 4074871
Preview
| Coordinates | 4074871.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C44 H44 B F4 N O2 P2 Pt |
|---|---|
| Calculated formula | C44 H44 B F4 N O2 P2 Pt |
| SMILES | [Pt]12([P]([C@@]34[C@H]([P]1(c1ccccc1)c1ccccc1)C[C@@H]([C@@H](C3)O)O4)(c1ccccc1)c1ccccc1)c1ccc3ccccc3c1[C@@H]([N]2(C)C)C.[B](F)(F)(F)[F-] |
| Title of publication | Functionalization of Metal-Protected Chiral Phosphines via Simple Organic Transformations |
| Authors of publication | Yeo, Wee-Chuan; Vittal, Jagadese J.; Koh, Lip Lin; Tan, Geok Kheng; Leung, Pak-Hing |
| Journal of publication | Organometallics |
| Year of publication | 2006 |
| Journal volume | 25 |
| Journal issue | 5 |
| Pages of publication | 1259 - 1269 |
| a | 11.6519 ± 0.0006 Å |
| b | 15.9927 ± 0.0007 Å |
| c | 21.0891 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3929.9 ± 0.3 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 8 |
| 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 | 0.0729 |
| Residual factor for significantly intense reflections | 0.0518 |
| Weighted residual factors for significantly intense reflections | 0.0891 |
| Weighted residual factors for all reflections included in the refinement | 0.0934 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 209819 (current) | 2018-08-16 | cif/4/ Updating bibliography in entries 4060914-4060919, 4074869-4074874. Marking entries 4060914-4060919 as duplicates of entries 4074869-4074874. |
4074871.cif |
| 178637 | 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 4/07/48. |
4074871.cif |
| 130086 | 2015-01-23 | cod/ (robertas@burundukas) The 'cif_fix_values' program was applied to CIFs that have generated the validation messages containing tag '_exptl_crystal_density_meas'. 16946 CIFs had a values that were perceived as 'not measured' and they were changed to '?'. The total of 17089 CIFs was changed. Those that were not corrected by 'cif_fix_values' were reformatted by the parser (e.g. a doi tag was moved to another place). The processing command was: mysql -u cod_reader -h www.crystallography.net cod -e \ 'select distinct codid from validation \ where message like \ "%tag%_exptl_crystal_density_meas'\''%"' -NB \ | xargs -i sh -c 'cif_fix_values {} \ | cif_filter --add-cif-header {} \ | sponge {}' |
4074871.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4074871.cif |
| 48925 | 2012-03-27 | ../uploads/cif-deposit/cod/cif Adding structures of 4074871 via cif-deposit CGI script. |
4074871.cif |
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