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Information card for entry 1568008
Preview
| Coordinates | 1568008.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H25 Au Cl F3 N O4 P S |
|---|---|
| Calculated formula | C34 H25 Au Cl F3 N O4 P S |
| Title of publication | Placing gold on a π±surface: ligand design and impact on reactivity |
| Authors of publication | Liu, Wei-Chun; Gabbaï, François P. |
| Journal of publication | Chemical Science |
| Year of publication | 2023 |
| Journal volume | 14 |
| Journal issue | 2 |
| Pages of publication | 277 - 283 |
| a | 8.73 ± 0.0005 Å |
| b | 13.2735 ± 0.0007 Å |
| c | 14.5419 ± 0.0008 Å |
| α | 80.962 ± 0.002° |
| β | 75.294 ± 0.001° |
| γ | 80.841 ± 0.002° |
| Cell volume | 1597.04 ± 0.15 Å3 |
| Cell temperature | 110 K |
| Ambient diffraction temperature | 110 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0186 |
| Residual factor for significantly intense reflections | 0.017 |
| Weighted residual factors for significantly intense reflections | 0.0404 |
| Weighted residual factors for all reflections included in the refinement | 0.0412 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 282621 (current) | 2023-04-13 | cod/ (saulius@tasmanijos-velnias) Fixing incorrectly parsed author names: codslave 'select file from data where authors like "%|%"' -NB | codid2file | xargs -i sh -c 'DOI=$(awk "/^_journal_paper_doi/ {print \$2}" {}); MRK=$(basename $DOI).mrk; if ! [ -f $MRK ]; then ( set -x; crossref-get-biblio --doi $DOI > $MRK ) fi; head -v $MRK' codslave 'select file from data where authors like "%|%"' -NB | codid2file | xargs -i sh -c 'DOI=$(awk "/^_journal_paper_doi/ {print \$2}" {}); MRK=$(basename $DOI).mrk; set -x; cif_filter --use-all-datablocks --biblio $MRK --fold-title --add-cif-header {} {} | sponge {}' Commands and program versions: saulius@tasmanijos-velnias restore-biblio/ $ type codslave codslave is aliased to `mysql -u cod_reader -h sql.crystallography.net cod -e' saulius@tasmanijos-velnias restore-biblio/ $ type codid2file codid2file is /home/saulius/scripts/codid2file saulius@tasmanijos-velnias restore-biblio/ $ type cif_filter cif_filter is hashed (/usr/bin/cif_filter) saulius@tasmanijos-velnias restore-biblio/ $ cif_filter --version cod-tools version 2.10 |
1568008.cif |
| 281368 | 2023-03-04 | cif/ Updating files of 1568005, 1568006, 1568007, 1568008, 1568009, 1568010, 1568011 Original log message: Adding full bibliography for 1568005--1568011.cif. |
1568008.cif |
| 279478 | 2022-11-23 | cif/ Adding structures of 1568005, 1568006, 1568007, 1568008, 1568009, 1568010, 1568011 via cif-deposit CGI script. |
1568008.cif |
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Users of the data should acknowledge the original authors of the
structural data.