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Information card for entry 4076301
Preview
| Coordinates | 4076301.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C106.5 H38.75 Cl2.25 Co F6 P3 Pd |
|---|---|
| Calculated formula | C106.5 H38.75 Cl2.25 Co F6 P3 Pd |
| Title of publication | Synthetic and Structural Studies on the Transition-Metal Fullerene Complexes (η2-C60)M[(η5-Ph2PC5H4)2Ru] and (η2-C60)M[(η5-Ph2PC5H4)2Co]+(PF6)-(M = Pd, Pt) and the Related Compound {[η5-Ph2P(O)C5H4]2Co}+(PF6)- |
| Authors of publication | Song, Li-Cheng; Yu, Guang-Ao; Su, Fu-Hai; Hu, Qing-Mei |
| Journal of publication | Organometallics |
| Year of publication | 2004 |
| Journal volume | 23 |
| Journal issue | 18 |
| Pages of publication | 4192 |
| a | 14.747 ± 0.004 Å |
| b | 24.155 ± 0.009 Å |
| c | 19.768 ± 0.006 Å |
| α | 90° |
| β | 90.541 ± 0.01° |
| γ | 90° |
| Cell volume | 7041 ± 4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1412 |
| Residual factor for significantly intense reflections | 0.0642 |
| Weighted residual factors for significantly intense reflections | 0.1225 |
| Weighted residual factors for all reflections included in the refinement | 0.1563 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4076301.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 {}' |
4076301.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4076301.cif |
| 51752 | 2012-04-07 | ../uploads/cif-deposit/cod/cif Adding structures of 4076301 via cif-deposit CGI script. |
4076301.cif |
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