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Information card for entry 4076678
Preview
| Coordinates | 4076678.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | (P-N)Pt(C4Ph4)-Pt(PhCCPh) |
|---|---|
| Formula | C55 H57 N P Pt2 |
| Calculated formula | C55 H57 N P Pt2 |
| Title of publication | Chelating P,N versus P,P Ligands: Differing Reactivity of Donor-Stabilized Pt(η2-PhC⋮CPh) Complexes Toward Diphenylacetylene |
| Authors of publication | Müller, Christian; Lachicotte, Rene J.; Jones, William D. |
| Journal of publication | Organometallics |
| Year of publication | 2002 |
| Journal volume | 21 |
| Journal issue | 6 |
| Pages of publication | 1118 |
| a | 10.7273 ± 0.0006 Å |
| b | 12.2851 ± 0.0007 Å |
| c | 18.8806 ± 0.001 Å |
| α | 100.916 ± 0.001° |
| β | 104.853 ± 0.001° |
| γ | 99.34 ± 0.001° |
| Cell volume | 2302.5 ± 0.2 Å3 |
| Cell temperature | 193 ± 2 K |
| Ambient diffraction temperature | 193 ± 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 | 0.0668 |
| Residual factor for significantly intense reflections | 0.0419 |
| Weighted residual factors for significantly intense reflections | 0.0739 |
| Weighted residual factors for all reflections included in the refinement | 0.0797 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.985 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178655 (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 4/07/66. |
4076678.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 {}' |
4076678.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4076678.cif |
| 54028 | 2012-04-20 | cif/ Adding structures of 4076675, 4076676, 4076677, 4076678 via cif-deposit CGI script. |
4076678.cif |
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Users of the data should acknowledge the original authors of the
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