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Information card for entry 4339876
Preview
| Coordinates | 4339876.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [Co8(L1)6(OH)4(H2O)4]5H2O |
|---|---|
| Chemical name | [Co8(L1)6(OH)4(H2O)4]5H2O |
| Formula | C96 H76 Co8 N18 O37 |
| Calculated formula | C96 H54 Co8 N18 O37 |
| Title of publication | Unprecedented (3,10)-connected 2-D metal-organic framework constructed from octanuclear cobalt(II) clusters and a new bifunctional ligand. |
| Authors of publication | Zou, Wen-Qiang; Wang, Ming-Sheng; Li, Yan; Wu, A-Qing; Zheng, Fa-Kun; Chen, Qi-Yong; Guo, Guo-Cong; Huang, Jin-Shun |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2007 |
| Journal volume | 46 |
| Journal issue | 17 |
| Pages of publication | 6852 - 6854 |
| a | 40.58 ± 0.007 Å |
| b | 11.021 ± 0.002 Å |
| c | 22.269 ± 0.004 Å |
| α | 90° |
| β | 95.43 ± 0.004° |
| γ | 90° |
| Cell volume | 9915 ± 3 Å3 |
| Cell temperature | 133 ± 2 K |
| Ambient diffraction temperature | 133 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0616 |
| Residual factor for significantly intense reflections | 0.0505 |
| Weighted residual factors for significantly intense reflections | 0.1305 |
| Weighted residual factors for all reflections included in the refinement | 0.1406 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.018 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179501 (current) | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/98. |
4339876.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. |
4339876.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 {}' |
4339876.cif |
| 117599 | 2014-06-15 | cif/ Adding structures of 4339876 via cif-deposit CGI script. |
4339876.cif |
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Users of the data should acknowledge the original authors of the
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