Information card for entry 7009428
| Formula |
C42 H37 Fe N11 O9 |
| Calculated formula |
C42 H30 Fe N11 O8.99 |
| Title of publication |
Development of supramolecular structure through alkylation of pendant pyridyl functionality |
| Authors of publication |
Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Phillips, David; Raithby, Paul R.; Schofield, Emma; Sparr, Emma; Tocher, Derek A.; Zehnder, Margareta; Zimmermann, Yves |
| Journal of publication |
Journal of the Chemical Society, Dalton Transactions |
| Year of publication |
2000 |
| Journal issue |
13 |
| Pages of publication |
2219 |
| a |
12.4568 ± 0.0015 Å |
| b |
15.476 ± 0.002 Å |
| c |
10.9876 ± 0.0013 Å |
| α |
96.259 ± 0.008° |
| β |
98.24 ± 0.005° |
| γ |
101.269 ± 0.009° |
| Cell volume |
2035.3 ± 0.4 Å3 |
| Cell temperature |
150 K |
| Number of distinct elements |
5 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0923 |
| Residual factor for significantly intense reflections |
0.0872 |
| Weighted residual factors for significantly intense reflections |
0.2186 |
| Weighted residual factors for all reflections included in the refinement |
0.2235 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.13 |
| Diffraction radiation wavelength |
0.71069 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/7009428.html
