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Information card for entry 4000360
Preview
| Coordinates | 4000360.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H18 Al N3 O3 |
|---|---|
| Calculated formula | C27 H18 Al N3 O3 |
| SMILES | c1cc2O[Al]34([n]5c2c(c1)ccc5)(Oc1c2[n]4cccc2ccc1)Oc1c2[n]3cccc2ccc1 |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2004 |
| a | 8.3281 Å |
| b | 10.1862 Å |
| c | 13.0623 Å |
| α | 108.234° |
| β | 96.5297° |
| γ | 91.6791° |
| Cell volume | 1043.15 Å3 |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Method of determination | theoretical |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178377 (current) | 2016-03-21 | cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00. |
4000360.cif |
| 158826 | 2015-09-28 | cif/4/00/03/ Adding determination method, missing formulae and Z for structures 4000358-4000360 according to original publication. |
4000360.cif |
| 130149 | 2015-01-27 | cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command. |
4000360.cif |
| 120677 | 2014-07-23 | cod/ (saulius@koala.ibt.lt) Adding 4906 DOIs identified by CodBot. |
4000360.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4000360.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. |
4000360.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/' |
4000360.cif |
| 14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
4000360.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. |
4000360.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) |
4000360.cif |
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Users of the data should acknowledge the original authors of the
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