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Information card for entry 4510489
Preview
| Coordinates | 4510489.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H14 O |
|---|---|
| Calculated formula | C10 H14 O |
| SMILES | C1(=O)C2CC3CC1CC(C3)C2 |
| Title of publication | Polymorphism of 2-Adamantanone |
| Authors of publication | Negrier, P.; Barrio, M.; Romanini, M.; Tamarit, J. Ll.; Mondieig, D.; Krivchikov, A. I.; Kepinski, L.; Jezowski, A.; Szewczyk, D. |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2014 |
| Journal volume | 14 |
| Journal issue | 5 |
| Pages of publication | 2626 |
| a | 6.8884 ± 0.0018 Å |
| b | 10.83 ± 0.003 Å |
| c | 10.658 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 795.1 ± 0.4 Å3 |
| Cell temperature | 190 K |
| Ambient diffraction temperature | 190 K |
| Number of distinct elements | 3 |
| Space group number | 36 |
| Hermann-Mauguin space group symbol | C m c 21 |
| Hall space group symbol | C 2c -2 |
| Diffraction radiation wavelength | 1.54056 Å |
| Diffraction radiation type | CuKα~1~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179651 (current) | 2016-03-24 | cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/04. |
4510489.cif |
| 115632 | 2014-06-05 | cif/ Updating files of 4510488, 4510489 Original log message: Adding full bibliography for 4510488--4510489.cif. |
4510489.cif |
| 111497 | 2014-04-24 | cif/ Adding structures of 4510489 via cif-deposit CGI script. |
4510489.cif |
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Users of the data should acknowledge the original authors of the
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