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Information card for entry 7232188
Preview
| Coordinates | 7232188.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C62 H2 Br2 Cl4 |
|---|---|
| Calculated formula | C1.99992 H1.99992 Br2.00016 Cl4.00032 Sp |
| Title of publication | Ordered and disordered solvates of C60 and CBrCl2H |
| Authors of publication | Ye, Jin; Barrio, Maria; Céolin, René; Qureshi, Navid; Negrier, Philippe; Rietveld, Ivo B.; Tamarit, Josep Lluís |
| Journal of publication | CrystEngComm |
| Year of publication | 2019 |
| Journal volume | 21 |
| Journal issue | 7 |
| Pages of publication | 1180 |
| a | 10.1313 ± 0.0017 Å |
| b | 10.1313 ± 0.0017 Å |
| c | 10.1351 ± 0.0017 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 900.9 ± 0.3 Å3 |
| Cell temperature | 300 K |
| Ambient diffraction temperature | 300 K |
| Number of distinct elements | 4 |
| Space group number | 191 |
| Hermann-Mauguin space group symbol | P 6/m m m |
| Hall space group symbol | -P 6 2 |
| Residual factor R(I) for significantly intense reflections | 7.7596 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 1.54056 Å |
| Diffraction radiation type | CuKα~1~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 223652 (current) | 2019-11-07 | cif/ Updating files of 7232188, 7232189 Original log message: Adding full bibliography for 7232188--7232189.cif. |
7232188.cif |
| 213215 | 2019-01-19 | cif/ Adding structures of 7232188, 7232189 via cif-deposit CGI script. |
7232188.cif |
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Users of the data should acknowledge the original authors of the
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