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Information card for entry 7236842
Preview
| Coordinates | 7236842.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C52 H56 S2 Si2 |
|---|---|
| Calculated formula | C52 H56 S2 Si2 |
| Title of publication | Orthogonal 4,10 and 6,12 substitution of dibenzo[def,mno]chrysene polycyclic aromatic small molecules |
| Authors of publication | Koldemir, Unsal; Tinkham, Jonathan S.; Johnson, Robert; Lim, Bogyu; Yemam, Henok A.; Gagnon, Kevin J.; Parkin, Sean; Sellinger, Alan |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2017 |
| Journal volume | 5 |
| Journal issue | 34 |
| Pages of publication | 8723 |
| a | 12.9931 ± 0.0005 Å |
| b | 11.3571 ± 0.0004 Å |
| c | 15.9701 ± 0.0006 Å |
| α | 90° |
| β | 109.323 ± 0.002° |
| γ | 90° |
| Cell volume | 2223.86 ± 0.15 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0871 |
| Residual factor for significantly intense reflections | 0.0504 |
| Weighted residual factors for significantly intense reflections | 0.1194 |
| Weighted residual factors for all reflections included in the refinement | 0.1375 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.8857 Å |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 236567 (current) | 2019-11-24 | cif/ Adding structures of 7236842, 7236843 via cif-deposit CGI script. |
7236842.cif |
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Users of the data should acknowledge the original authors of the
structural data.