Information card for entry 2230989
Chemical name |
(8a<i>RS</i>)-8,8a-Dihydrofuro[3,2-<i>f</i>]indolizine- 6,9(4<i>H</i>,7<i>H</i>)-dione |
Formula |
C10 H9 N O3 |
Calculated formula |
C10 H9 N O3 |
SMILES |
C1(=O)CCC2C(=O)c3c(cco3)CN12 |
Title of publication |
(8a<i>RS</i>)-8,8a-Dihydrofuro[3,2-<i>f</i>]indolizine-6,9(4<i>H</i>,7<i>H</i>)-dione |
Authors of publication |
Vrábel, Viktor; Sivý, Július; Švorc, Łubomír; Šafář, Peter; Marchalín, Štefan |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2011 |
Journal volume |
67 |
Journal issue |
8 |
Pages of publication |
o2035 |
a |
7.63534 ± 0.00019 Å |
b |
11.7583 ± 0.0002 Å |
c |
9.9234 ± 0.0003 Å |
α |
90° |
β |
105.775 ± 0.003° |
γ |
90° |
Cell volume |
857.35 ± 0.04 Å3 |
Cell temperature |
298 ± 2 K |
Ambient diffraction temperature |
298 ± 2 K |
Number of distinct elements |
4 |
Space group number |
14 |
Hermann-Mauguin space group symbol |
P 1 21/n 1 |
Hall space group symbol |
-P 2yn |
Residual factor for all reflections |
0.0564 |
Residual factor for significantly intense reflections |
0.0402 |
Weighted residual factors for significantly intense reflections |
0.1127 |
Weighted residual factors for all reflections included in the refinement |
0.1199 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.03 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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The link is:
https://www.crystallography.net/2230989.html