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Information card for entry 7011136
Preview
| Coordinates | 7011136.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C74 H67 F6 O3.5 P5 Pt2 S2 V |
|---|---|
| Calculated formula | C74 H66 F6 O3.5 P5 Pt2 S2 V |
| SMILES | [Pt]1([S]2[Pt]([S]1[V]2(=O)(OC)OC)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-].O |
| Title of publication | Mass spectrometry-directed synthesis of 'early‒late' sulfide-bridged heterobimetallic complexes from the metalloligand [Pt2(PPh3)4(µ-S)2] and oxo compounds of vanadium(v), molybdenum(vi) and uranium(vi) |
| Authors of publication | Fong, S.-W. Audi; Yap, Woon Teck; Vittal, Jagadese J.; Henderson, William; Hor, T. S. Andy |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2002 |
| Journal issue | 8 |
| Pages of publication | 1826 |
| a | 17.7574 ± 0.0004 Å |
| b | 41.8464 ± 0.0009 Å |
| c | 19.3758 ± 0.0004 Å |
| α | 90° |
| β | 92.614 ± 0.001° |
| γ | 90° |
| Cell volume | 14382.9 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1338 |
| Residual factor for significantly intense reflections | 0.0776 |
| Weighted residual factors for significantly intense reflections | 0.1813 |
| Weighted residual factors for all reflections included in the refinement | 0.2047 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7011136.cif |
| 129439 | 2015-01-07 | cod/ (robertas@burundukas) Correcting values of _exptl_crystal_density_meas and _exptl_crystal_density_method data items: codsql "select codid from validation where message like '%\\'_exptl_crystal_density_meas\\' value \"not measured\" is %'" -NB \ | codid2file \ | xargs perl -i -pe "s/_exptl_crystal_density_meas\\s+'not +measured'/_exptl_crystal_density_meas ?/i; \ s/_exptl_crystal_density_method\\s+('not +measured'|\\?|none)/_exptl_crystal_density_method ./i" |
7011136.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7011136.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7011136.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7011136.cif |
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Users of the data should acknowledge the original authors of the
structural data.