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Information card for entry 1010411
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| Coordinates | 1010411.cif |
|---|
| Chemical name | Phosphorus(V) chloride |
|---|---|
| Formula | Cl5 P |
| Calculated formula | Cl1.75 P |
| SMILES | P(Cl)(Cl)(Cl)(Cl)Cl |
| Title of publication | Crystal Structure of Phosphorus Pentachloride |
| Authors of publication | Powell, H M; Clark, D; Wells, A F |
| Journal of publication | Nature (London) |
| Year of publication | 1940 |
| Journal volume | 145 |
| Pages of publication | 149 - 149 |
| a | 9.2 Å |
| b | 9.2 Å |
| c | 7.4 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 626.3 Å3 |
| Number of distinct elements | 2 |
| Space group number | 85 |
| Hermann-Mauguin space group symbol | P 4/n :1 |
| Hall space group symbol | P 4ab -1ab |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1010411.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
1010411.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. |
1010411.cif |
| 853 | 2009-11-16 | cif/ Reconstructing spacegroup designators from the symmetry operators were possible. The comands used can be found in the log file reformat-spacegroups-2009.11.14.log committed with the current revision. Only lines that contained spacegroup designators were changed, and all files pass vcif test after the conversion. |
1010411.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/' |
1010411.cif |
| 14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
1010411.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. |
1010411.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) |
1010411.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.