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Information card for entry 4075334
Preview
| Coordinates | 4075334.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Ceriumocene |
|---|---|
| Chemical name | tris-cyclopentadienyl-cerium(III) |
| Formula | C15 H15 Ce |
| Calculated formula | C15 H15 Ce |
| Title of publication | Synthesis, Structure, and Dynamics of Tris(η5-cyclopentadienyl)lanthanides and Bis(η5-cyclopentadienyl)[bis(trimethylsilyl)amido]cerium(III) |
| Authors of publication | Baisch, Ulrich; Pagano, Sandro; Zeuner, Martin; Schmedt auf der Günne, Jörn; Oeckler, Oliver; Schnick, Wolfgang |
| Journal of publication | Organometallics |
| Year of publication | 2006 |
| Journal volume | 25 |
| Journal issue | 12 |
| Pages of publication | 3027 |
| a | 15.101 ± 0.003 Å |
| b | 9.6683 ± 0.0019 Å |
| c | 16.621 ± 0.003 Å |
| α | 90° |
| β | 93.1 ± 0.03° |
| γ | 90° |
| Cell volume | 2423.1 ± 0.8 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 3 |
| 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 | 0.1575 |
| Residual factor for significantly intense reflections | 0.1069 |
| Weighted residual factors for significantly intense reflections | 0.318 |
| Weighted residual factors for all reflections included in the refinement | 0.3485 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4075334.cif |
| 171491 | 2015-12-13 | cif/ (antanas@echidna.ibt.lt) Removing surrounding qoutes ("'") from the _chemical_name_systematic tag values in multiple entries in range 4. |
4075334.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 {}' |
4075334.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4075334.cif |
| 49184 | 2012-03-27 | ../uploads/cif-deposit/cod/cif Adding structures of 4075334 via cif-deposit CGI script. |
4075334.cif |
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