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Information card for entry 7238810
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| Coordinates | 7238810.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 3-hydroxy-4-phenyl-3-cyclobutene-1,2-dione |
|---|---|
| Chemical name | 3-hydroxy-4-phenyl-3-cyclobutene-1,2-dione |
| Formula | C10 H8 O4 |
| Calculated formula | C10 H8 O4 |
| Title of publication | Hydrogel formed by a simple squaric acid derivative |
| Authors of publication | Ohsedo, Yutaka; Miyamoto, Misao; Oono, Masashi; Shikii, Kazuaki; Tanaka, Akihiro |
| Journal of publication | RSC Advances |
| Year of publication | 2013 |
| Journal volume | 3 |
| Journal issue | 12 |
| Pages of publication | 3844 |
| a | 6.9284 ± 0.0004 Å |
| b | 8.1002 ± 0.0005 Å |
| c | 9.1236 ± 0.0005 Å |
| α | 75.226 ± 0.003° |
| β | 85.617 ± 0.003° |
| γ | 66.772 ± 0.003° |
| Cell volume | 454.8 ± 0.05 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0373 |
| Residual factor for significantly intense reflections | 0.0362 |
| Weighted residual factors for significantly intense reflections | 0.098 |
| Weighted residual factors for all reflections included in the refinement | 0.0993 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244367 (current) | 2019-11-28 | cif/ Adding structures of 7238810 via cif-deposit CGI script. |
7238810.cif |
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Users of the data should acknowledge the original authors of the
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