Information card for entry 2211817
Chemical name |
Diethyl 2,13-dioxo-16,18-dioxa-1,3,12,14- tetraazapentacyclo[10.7.2.0^3,21^.0^5,10^.0^14,20^]undeca-5,7,9-triene- 20,21-dicarboxylate |
Formula |
C21 H24 N4 O8 |
Calculated formula |
C21 H24 N4 O8 |
Title of publication |
Diethyl 2,13-dioxo-16,18-dioxa-1,3,12,14-tetraazapentacyclo[10.7.2.0^3,21^.0^5,10^.0^14,20^]undeca-5,7,9-triene-20,21-dicarboxylate |
Authors of publication |
Bao-Han Zhou; Li-Ping Cao; Yu-Zhou Wang; Meng Gao |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2007 |
Journal volume |
63 |
Journal issue |
1 |
Pages of publication |
o65 - o66 |
a |
8.4954 ± 0.0008 Å |
b |
15.0557 ± 0.0013 Å |
c |
17.2379 ± 0.0016 Å |
α |
90° |
β |
91.541 ± 0.002° |
γ |
90° |
Cell volume |
2204 ± 0.3 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/c 1 |
Hall space group symbol |
-P 2ybc |
Residual factor for all reflections |
0.0843 |
Residual factor for significantly intense reflections |
0.0643 |
Weighted residual factors for significantly intense reflections |
0.1796 |
Weighted residual factors for all reflections included in the refinement |
0.196 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.006 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
Yes |
Has Fobs |
Yes |
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https://www.crystallography.net/2211817.html