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Information card for entry 6000698
Preview
| Coordinates | 6000698.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H14 O |
|---|---|
| Calculated formula | C10 H14 O |
| Title of publication | Chiral molecular alloys: Patterson-search structure determination of (L)-carvone and (DL)-carvone from X-ray powder diffraction data at 218 K |
| Authors of publication | Sañé, J.; Ruis, J.; Calvet, T.; Cuevas-Diarte, M. A. |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 1997 |
| Journal volume | 53 |
| Journal issue | 4 |
| Pages of publication | 702 - 707 |
| a | 6.8576 ± 0.0003 Å |
| b | 6.8831 ± 0.0005 Å |
| c | 19.988 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 943.5 ± 0.1 Å3 |
| Ambient diffraction temperature | 218 K |
| Number of distinct elements | 3 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Diffraction radiation wavelength | 1.54051 Å |
| Diffraction radiation type | CuKα~1~ |
| Duplicate of | 2101879 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 208463 (current) | 2018-06-17 | cif/ Merging information from duplicate entries 2101879, 6000698 and updating the space group information in these entries. |
6000698.cif |
| 188689 | 2016-11-26 | Updated bibliography in entries 6000698, 6000699. Marked entries 6000698 and 6000699 as duplicates of entries 2101879 and 2101880 respectively. |
6000698.cif |
| 176292 | 2016-02-09 | cif/6/ (antanas@kurmis) Removing the _[local]_cod_text data item from multiple entries in range 6, since it held the same information as other data items in the entries (bibliography data items, for example). Also, bibliography was updated in several entries. |
6000698.cif |
| 130149 | 2015-01-27 | cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command. |
6000698.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
6000698.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. |
6000698.cif |
| 878 | 2009-11-19 | cif/6/ Splitting the corrected 6.cif file, adding the splitted range 6 files: cif_split_primitive -o 6/ < 6.cif |
6000698.cif |
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Users of the data should acknowledge the original authors of the
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