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Information card for entry 7210197
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| Coordinates | 7210197.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C44 H34 Co4 N4 O37 |
|---|---|
| Calculated formula | C44 H16 Co4 N4 O36.94 |
| Title of publication | Mellitate-based coordination polymers with a recurring motif: controlling dimensionality with secondary ligands |
| Authors of publication | Li, Meng-Yuan; Sevov, Slavi C. |
| Journal of publication | CrystEngComm |
| Year of publication | 2013 |
| Journal volume | 15 |
| Journal issue | 25 |
| Pages of publication | 5107 |
| a | 11.333 ± 0.0007 Å |
| b | 15.2656 ± 0.001 Å |
| c | 15.6223 ± 0.001 Å |
| α | 98.946 ± 0.003° |
| β | 101.634 ± 0.003° |
| γ | 90.142 ± 0.003° |
| Cell volume | 2613.4 ± 0.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.1082 |
| Residual factor for significantly intense reflections | 0.0603 |
| Weighted residual factors for significantly intense reflections | 0.1469 |
| Weighted residual factors for all reflections included in the refinement | 0.1703 |
| 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 |
|---|---|---|---|
| 180432 (current) | 2016-03-26 | cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/01. |
7210197.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 {}' |
7210197.cif |
| 87057 | 2013-07-13 | cif/ Adding structures of 7210197, 7210198, 7210199 via cif-deposit CGI script. |
7210197.cif |
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Users of the data should acknowledge the original authors of the
structural data.