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Information card for entry 7233182
Preview
| Coordinates | 7233182.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H30 O8 S2 |
|---|---|
| Calculated formula | C32 H30 O8 S2 |
| Title of publication | Water soluble pentacene |
| Authors of publication | Chandrani Pramanik; Yushu Li; Anup Singh; Weimin Lin; Jennifer L. Hodgson; Jonathan B. Briggs; Simka Ellis; Peter Muller; Nicol E. McGruer; Glen P. Miller |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2013 |
| Journal volume | 1 |
| Pages of publication | 2193 - 2201 |
| a | 5.0554 ± 0.0004 Å |
| b | 10.5514 ± 0.0008 Å |
| c | 13.4788 ± 0.001 Å |
| α | 100.067 ± 0.002° |
| β | 94.337 ± 0.002° |
| γ | 92.778 ± 0.002° |
| Cell volume | 704.49 ± 0.09 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0655 |
| Residual factor for significantly intense reflections | 0.0489 |
| Weighted residual factors for significantly intense reflections | 0.141 |
| Weighted residual factors for all reflections included in the refinement | 0.1669 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.748 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 217114 (current) | 2019-07-17 | cif/ Adding structures of 7233182 via cif-deposit CGI script. |
7233182.cif |
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Users of the data should acknowledge the original authors of the
structural data.