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Information card for entry 7107957
Preview
| Coordinates | 7107957.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H11 Cu N O6 |
|---|---|
| Calculated formula | C17 H11 Cu N O6 |
| Title of publication | High and selective CO2 capture by two mesoporous acylamide-functionalized rht-type metal-organic frameworks |
| Authors of publication | Junfeng Bai; Baishu Zheng; Yizhi Li; Zhen Yang; Shuhua Li |
| Journal of publication | Chem.Commun. |
| Year of publication | 2012 |
| Journal volume | 48 |
| Pages of publication | 7025 |
| a | 52.557 ± 0.003 Å |
| b | 52.557 ± 0.003 Å |
| c | 52.557 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 145175 ± 14 Å3 |
| Cell temperature | 291 ± 2 K |
| Ambient diffraction temperature | 291 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 225 |
| Hermann-Mauguin space group symbol | F m -3 m |
| Hall space group symbol | -F 4 2 3 |
| Residual factor for all reflections | 0.062 |
| Residual factor for significantly intense reflections | 0.0398 |
| Weighted residual factors for significantly intense reflections | 0.1094 |
| Weighted residual factors for all reflections included in the refinement | 0.1202 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180183 (current) | 2016-03-26 | cif/7/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/10/79. |
7107957.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 {}' |
7107957.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7107957.cif |
| 60910 | 2012-06-19 | cif/ Adding structures of 7107957 via cif-deposit CGI script. |
7107957.cif |
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