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Information card for entry 1007202
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| Coordinates | 1007202.cif |
|---|
| Chemical name | Ammonium cyclo-hexaphosphate - ammonium iodide - water (1/1/1) |
|---|---|
| Formula | H30 I N7 O19 P6 |
| Calculated formula | H30 I N7 O19 P6 |
| Title of publication | (NH~4~)~6~P~6~O~18~.NH~4~X.H~2~O (X=Cl,Br,I). The first examples of cyclohexaphosphate-halides |
| Authors of publication | Averbuch-Pouchot, M T; Durif, A |
| Journal of publication | European Journal of Solid State Inorganic Chemistry |
| Year of publication | 1993 |
| Journal volume | 30 |
| Pages of publication | 447 - 459 |
| a | 14.96 ± 0.01 Å |
| b | 24.819 ± 0.009 Å |
| c | 6.71 ± 0.006 Å |
| α | 90° |
| β | 91.86 ± 0.05° |
| γ | 90° |
| Cell volume | 2490.1 Å3 |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.032 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 200452 (current) | 2017-09-11 | cif/1/ Removing dummy H atoms since the hydrogen atoms they represent are already marked using the _atom_site_attached_hydrogens data item. |
1007202.cif |
| 185995 | 2016-08-25 | cif/1/00/ Reducing '_atom_site_attached_hydrogens' values for nitrogen atoms from 4 to 0 since the hydrogens atoms are stated explicitly in the coordinate block. Adding 2 attached hydrogens to the oxygen atom of the water molecule. |
1007202.cif |
| 130149 | 2015-01-27 | cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command. |
1007202.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
1007202.cif |
| 966 | 2010-01-30 | cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated. |
1007202.cif |
| 19 | 2008-01-26 | Changing all end-of-line codes from DOS style to UNIX style in all COD CIF files, for more convenient processing: In the cod/cif/ directory: ff \*.cif | xargs perl -i -pe 's/\r\n/\n/' |
1007202.cif |
| 14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
1007202.cif |
| 13 | 2008-01-13 | Setting the svn:keywords property to "Author Date Revision URL Id" for all CIF files in the cod/cif directory. |
1007202.cif |
| 1 | 2007-11-30 | Adding all .cif files from the COD, downloaded in a Cod.zip file on 2007.02.07 (and the same Cod.zip is downloadable today, on 2007.11.29) |
1007202.cif |
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