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Information card for entry 5000238
Preview
| Coordinates | 5000238.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C11 H8 N2 O3 S2 |
|---|---|
| Calculated formula | C11 H7 N2 O3 S2 |
| Title of publication | The molecular structure of firefly D-(‒)-luciferin: A single crystal X-ray analysis |
| Authors of publication | Blank, G. E.; Pletcher, J.; Sax, M. |
| Journal of publication | Biochemical and Biophysical Research Communications |
| Year of publication | 1971 |
| Journal volume | 42 |
| Journal issue | 3 |
| Pages of publication | 583 - 588 |
| a | 9.248 Å |
| b | 22.97 Å |
| c | 5.331 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1132.45 Å3 |
| Number of distinct elements | 5 |
| 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 |
|---|---|---|---|
| 175443 (current) | 2016-02-03 | cif/5/00/02/ (antanas@kurmis) Updating bibliography for entry 5000237, 5000238, 5000239, 5000243, 5000245, 5000248, 5000249. |
5000238.cif |
| 130149 | 2015-01-27 | cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command. |
5000238.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
5000238.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. |
5000238.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/' |
5000238.cif |
| 14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
5000238.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. |
5000238.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) |
5000238.cif |
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.
Users of the data should acknowledge the original authors of the
structural data.