Information card for entry 2017297
| Chemical name |
5,10,15,20-tetra-4-pyridylporphyrin 2-chlorophenol disolvate |
| Formula |
C52 H36 Cl2 N8 O2 |
| Calculated formula |
C52 H36 Cl2 N8 O2 |
| Title of publication |
Unsolvated 5,10,15,20-tetra-4-pyridylporphyrin, its sesquihydrate and its 2-chlorophenol disolvate: conformational versatility of the ligand |
| Authors of publication |
Lipstman, Sophia; Goldberg, Israel |
| Journal of publication |
Acta Crystallographica Section C |
| Year of publication |
2009 |
| Journal volume |
65 |
| Journal issue |
9 |
| Pages of publication |
o447 - o452 |
| a |
6.5563 ± 0.0002 Å |
| b |
10.0441 ± 0.0003 Å |
| c |
16.1903 ± 0.0005 Å |
| α |
77.841 ± 0.002° |
| β |
88.9097 ± 0.0019° |
| γ |
79.6939 ± 0.0014° |
| Cell volume |
1025.24 ± 0.05 Å3 |
| Cell temperature |
110 ± 2 K |
| Ambient diffraction temperature |
110 ± 2 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 |
0.0823 |
| Residual factor for significantly intense reflections |
0.0583 |
| Weighted residual factors for significantly intense reflections |
0.1415 |
| Weighted residual factors for all reflections included in the refinement |
0.1558 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.032 |
| 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/2017297.html
