Information card for entry 2000054
Formula |
C9 H12 N2 O5 |
Calculated formula |
C9 H12 N2 O5 |
SMILES |
OC[C@H]1CC2(C[C@@H]1O)C(=O)NC(=O)NC2=O |
Title of publication |
(3S,2R)-3-Hydroxy-2-hydroxymethyl-7,9-diazaspiro[4.5]decane-6,8,10-trione |
Authors of publication |
Averbuch-Pouchot, M.-T.; Durif, A.; Renard, A.; Kotera, M.; Lhomme, J. |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2002 |
Journal volume |
58 |
Journal issue |
3 |
Pages of publication |
o256 - o258 |
a |
7.467 ± 0.002 Å |
b |
6.802 ± 0.001 Å |
c |
9.673 ± 0.003 Å |
α |
90° |
β |
108.07 ± 0.02° |
γ |
90° |
Cell volume |
467.065 Å3 |
Ambient diffraction temperature |
293 K |
Number of distinct elements |
4 |
Space group number |
4 |
Hermann-Mauguin space group symbol |
P 1 21 1 |
Hall space group symbol |
P 2yb |
Residual factor for significantly intense reflections |
0.0386 |
Weighted residual factors for significantly intense reflections |
0.0386 |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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The link is:
https://www.crystallography.net/2000054.html