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Information card for entry 7230397
Preview
| Coordinates | 7230397.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H57 Mo12 O43 P S3 |
|---|---|
| Calculated formula | C36 H57 Mo12 O43 P S3 |
| Title of publication | Aromatic sulfonium polyoxomolybdates: tuning the photochromic properties through substitutions on the counter ion moiety |
| Authors of publication | Kumar, Ashwani; Pradeep, Chullikkattil P. |
| Journal of publication | CrystEngComm |
| Year of publication | 2018 |
| a | 12.4149 ± 0.0007 Å |
| b | 12.6395 ± 0.0006 Å |
| c | 23.2868 ± 0.0009 Å |
| α | 95.806 ± 0.004° |
| β | 95.886 ± 0.004° |
| γ | 115.353 ± 0.005° |
| Cell volume | 3241.7 ± 0.3 Å3 |
| Cell temperature | 149.99 ± 0.1 K |
| Ambient diffraction temperature | 149.99 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.05 |
| Residual factor for significantly intense reflections | 0.042 |
| Weighted residual factors for significantly intense reflections | 0.1072 |
| Weighted residual factors for all reflections included in the refinement | 0.1141 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 207201 (current) | 2018-04-03 | cif/ Adding structures of 7230395, 7230396, 7230397 via cif-deposit CGI script. |
7230397.cif |
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Users of the data should acknowledge the original authors of the
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