Information card for entry 4081490
Formula |
C17 H18 Fe N2 O3 |
Calculated formula |
C17 H18 Fe N2 O3 |
Title of publication |
Metallocene-Modified Uracils: Synthesis, Structure, and Biological Activity |
Authors of publication |
Kowalski, Konrad; Skiba, Joanna; Oehninger, Luciano; Ott, Ingo; Solecka, Jolanta; Rajnisz, Aleksandra; Therrien, Bruno |
Journal of publication |
Organometallics |
Year of publication |
2013 |
Journal volume |
32 |
Journal issue |
20 |
Pages of publication |
5766 |
a |
10.1451 ± 0.0009 Å |
b |
11.0305 ± 0.0006 Å |
c |
13.9622 ± 0.0011 Å |
α |
90° |
β |
98.566 ± 0.007° |
γ |
90° |
Cell volume |
1545 ± 0.2 Å3 |
Cell temperature |
173 ± 2 K |
Ambient diffraction temperature |
173 ± 2 K |
Number of distinct elements |
5 |
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 |
0.087 |
Residual factor for significantly intense reflections |
0.0595 |
Weighted residual factors for significantly intense reflections |
0.1311 |
Weighted residual factors for all reflections included in the refinement |
0.1438 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.056 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
Yes |
Has Fobs |
No |
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https://www.crystallography.net/4081490.html