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Information card for entry 4339201
Preview
| Coordinates | 4339201.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C2 H9 N Np O11 P2 |
|---|---|
| Calculated formula | C2 H9 N Np O11 P2 |
| Title of publication | In situ hydrothermal reduction of neptunium(VI) as a route to neptunium(IV) phosphonates. |
| Authors of publication | Bray, Travis H.; Nelson, Anna-Gay D; Jin, Geng Bang; Haire, Richard G.; Albrecht-Schmitt, Thomas E |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2007 |
| Journal volume | 46 |
| Journal issue | 26 |
| Pages of publication | 10959 - 10961 |
| a | 10.607 ± 0.003 Å |
| b | 9.438 ± 0.003 Å |
| c | 11.346 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1135.8 ± 0.6 Å3 |
| Cell temperature | 193 ± 2 K |
| Ambient diffraction temperature | 193 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 29 |
| Hermann-Mauguin space group symbol | P c a 21 |
| Hall space group symbol | P 2c -2ac |
| Residual factor for all reflections | 0.0193 |
| Residual factor for significantly intense reflections | 0.0182 |
| Weighted residual factors for significantly intense reflections | 0.0429 |
| Weighted residual factors for all reflections included in the refinement | 0.0432 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.938 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179495 (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 4/33/92. |
4339201.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 {}' |
4339201.cif |
| 117204 | 2014-06-14 | cif/ Adding structures of 4339201 via cif-deposit CGI script. |
4339201.cif |
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Users of the data should acknowledge the original authors of the
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