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Information card for entry 2238390
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| Coordinates | 2238390.cif |
|---|---|
| Structure factors | 2238390.hkl |
| Original IUCr paper | HTML |
| Chemical name | (<i>E</i>)-Benzyl(1-phenylethylidene)amine |
|---|---|
| Formula | C15 H15 N |
| Calculated formula | C15 H15 N |
| SMILES | CC(=N\Cc1ccccc1)/c1ccccc1 |
| Title of publication | (<i>E</i>)-Benzyl(1-phenylethylidene)amine |
| Authors of publication | Majer, Sean H.; Tanski, Joseph M. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 8 |
| Pages of publication | o1289 |
| a | 5.4633 ± 0.0004 Å |
| b | 10.4173 ± 0.0008 Å |
| c | 20.2426 ± 0.0015 Å |
| α | 90° |
| β | 97.308 ± 0.001° |
| γ | 90° |
| Cell volume | 1142.71 ± 0.15 Å3 |
| Cell temperature | 125 ± 2 K |
| Ambient diffraction temperature | 125 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.074 |
| Residual factor for significantly intense reflections | 0.0469 |
| Weighted residual factors for significantly intense reflections | 0.1117 |
| Weighted residual factors for all reflections included in the refinement | 0.1268 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181305 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/83. |
2238390.cif 2238390.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2238390.cif 2238390.hkl |
| 89416 | 2013-10-25 | cif/ (saulius@koala.ibt.lt) Adding links pointing to FOBS data to the recently deposited structures from IUCr. |
2238390.cif 2238390.hkl |
| 89414 | 2013-10-24 | cod/ (saulius@koala.ibt.lt) Adding FOBS data for the recently deposited IUCr structures. |
2238390.cif 2238390.hkl |
| 88234 | 2013-09-04 | cif/ Adding structures of 2238390 via cif-deposit CGI script. |
2238390.cif |
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Users of the data should acknowledge the original authors of the
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