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Information card for entry 1100517
Preview
| Coordinates | 1100517.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H26 N2 O2 |
|---|---|
| Calculated formula | C22 H26 N2 O2 |
| SMILES | [C@H]12N(OC[C@H]1CN([C@@H]2[C@@H](O)c1ccccc1)CC=C)Cc1ccccc1 |
| Title of publication | Formation of enantiopure β-amino alcohols with a 3-oxa-2,7-diazabicyclo[3.3.0]octane framework |
| Authors of publication | Aurich, Hans Günter; Soeberdt, Michael; Harms, Klaus |
| Journal of publication | Tetrahedron |
| Year of publication | 1999 |
| Journal volume | 55 |
| Journal issue | 5 |
| Pages of publication | 1249 - 1270 |
| a | 7.515 ± 0.001 Å |
| b | 13.748 ± 0.001 Å |
| c | 18.678 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1929.74 Å3 |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178054 (current) | 2016-03-09 | cif/1/10/ (antanas@echidna.ibt.lt) Adding full bibliography for entries 1100516, 1100517, 1100518. |
1100517.cif |
| 130149 | 2015-01-27 | cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command. |
1100517.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
1100517.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. |
1100517.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/' |
1100517.cif |
| 14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
1100517.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. |
1100517.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) |
1100517.cif |
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Users of the data should acknowledge the original authors of the
structural data.