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Information card for entry 7218173
Preview
| Coordinates | 7218173.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Three-dimensional Manganese Sulfate |
|---|---|
| Formula | C0 H2.67 Mn0.67 N0.67 O4 S |
| Calculated formula | H2.66667 Mn0.666667 N0.666667 O4 S |
| Title of publication | Synthesis and characterization of robust three-dimensional chiral metal sulfates |
| Authors of publication | Behera, Jogendra Nath; Bhattacharjee, Joydeep; Horike, Satoshi; Marri, Subba Reddy; Dahiya, Prem |
| Journal of publication | RSC Adv. |
| Year of publication | 2014 |
| a | 10.1846 ± 0.0002 Å |
| b | 10.1846 ± 0.0002 Å |
| c | 10.1846 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1056.41 ± 0.04 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 198 |
| Hermann-Mauguin space group symbol | P 21 3 |
| Hall space group symbol | P 2ac 2ab 3 |
| Residual factor for all reflections | 0.0153 |
| Residual factor for significantly intense reflections | 0.015 |
| Weighted residual factors for significantly intense reflections | 0.0378 |
| Weighted residual factors for all reflections included in the refinement | 0.0379 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180512 (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 7/21/81. |
7218173.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 {}' |
7218173.cif |
| 124049 | 2014-09-20 | cif/ Adding structures of 7218173, 7218174 via cif-deposit CGI script. |
7218173.cif |
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Users of the data should acknowledge the original authors of the
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