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Information card for entry 7239795
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| Coordinates | 7239795.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 1,3-dimethyAdamantane |
|---|---|
| Formula | C12 H20 |
| Calculated formula | C12 H20 |
| Title of publication | Polymorphism of 1,3-X-adamantanes (X=Br, OH, CH3) and the crystal plastic phase formation ability |
| Authors of publication | Négrier, Philippe; Ben Hassine, Bacem; Barrio, Maria; Romanini, Michela; MONDIEIG, DENISE; Tamarit, Josep Lluis |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| a | 7.7576 ± 0.0018 Å |
| b | 12.0856 ± 0.0002 Å |
| c | 11.7068 ± 0.0019 Å |
| α | 90° |
| β | 112.271 ± 0.012° |
| γ | 90° |
| Cell volume | 1015.7 ± 0.3 Å3 |
| Cell temperature | 120 ± 1 K |
| Ambient diffraction temperature | 120 ± 1 K |
| Number of distinct elements | 2 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Diffraction radiation wavelength | 1.54056 Å |
| Diffraction radiation type | CuKα~1~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 247070 (current) | 2020-01-22 | cif/ Adding structures of 7239795 via cif-deposit CGI script. |
7239795.cif |
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