Information card for entry 8100713
Formula |
C11 H15 N O5 |
Calculated formula |
C11 H15 N O5 |
SMILES |
N1OC[C@@H]2[C@H]1[C@H]1OC(OC=1[C@@H]2OC(=O)C)(C)C |
Title of publication |
Crystal structure of (3aS,4R,5S,6R)-4-acetoxy-5,6-isopropylidenedioxy- 3a,4,5,6-tetrahydro-3H-cyclopent[c]isoxazole, C~11~H~15~NO~5~ |
Authors of publication |
Gültekin, Zeynep; Frey, Wolfgang; Jäger, Volker |
Journal of publication |
Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication |
2002 |
Journal volume |
217 |
Journal issue |
3 |
Pages of publication |
405 - 406 |
a |
5.5206 ± 0.0006 Å |
b |
14.0083 ± 0.0009 Å |
c |
15.6557 ± 0.0009 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
1210.72 ± 0.17 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 2 K |
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 |
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The link is:
https://www.crystallography.net/8100713.html