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Information card for entry 7212681
Preview
| Coordinates | 7212681.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | DL-cysteine |
|---|---|
| Formula | C3 H7 N O2 S |
| Calculated formula | C3 H7 N O2 S |
| Title of publication | Low temperature/high pressure polymorphism in dl-cysteine |
| Authors of publication | Minkov, Vasily S.; Tumanov, Nikolay A.; Cabrera, Raul Quesada; Boldyreva, Elena V. |
| Journal of publication | CrystEngComm |
| Year of publication | 2010 |
| Journal volume | 12 |
| Journal issue | 9 |
| Pages of publication | 2551 |
| a | 9.6352 ± 0.0004 Å |
| b | 4.9435 ± 0.0002 Å |
| c | 12.8853 ± 0.0005 Å |
| α | 90° |
| β | 121.808 ± 0.002° |
| γ | 90° |
| Cell volume | 521.57 ± 0.04 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Cell measurement pressure | 850000 kPa |
| Ambient diffracton pressure | 850000 kPa |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/a 1 |
| Hall space group symbol | -P 2yab |
| Goodness-of-fit parameter for all reflections | 0.1443 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.70007 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180457 (current) | 2016-03-26 | cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/26. |
7212681.cif |
| 93226 | 2014-01-12 | cif/ Adding structures of 7212681, 7212682 via cif-deposit CGI script. |
7212681.cif |
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Users of the data should acknowledge the original authors of the
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