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Information card for entry 2237841
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| Coordinates | 2237841.cif |
|---|---|
| Structure factors | 2237841.hkl |
| Original IUCr paper | HTML |
| Common name | 2-(4-(trifluoromethyl)phenyl)-1H-phenanthro[9,10-d]imidazole |
|---|---|
| Chemical name | 1-(4-Methylphenyl)-2-[4-(trifluoromethyl)phenyl]-1<i>H</i>-phenanthro[9,10-<i>d</i>]imidazole |
| Formula | C29 H19 F3 N2 |
| Calculated formula | C29 H19 F3 N2 |
| Title of publication | 1-(4-Methylphenyl)-2-[4-(trifluoromethyl)phenyl]-1<i>H</i>-phenanthro[9,10-<i>d</i>]imidazole |
| Authors of publication | Mohandas, T.; Sathishkumar, R.; Jayabharathi, J.; Pasupathy, A.; Sakthivel, P. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 5 |
| Pages of publication | o710 |
| a | 8.113 ± 0.003 Å |
| b | 11.733 ± 0.005 Å |
| c | 12.713 ± 0.002 Å |
| α | 76.397 ± 0.001° |
| β | 73.49 ± 0.002° |
| γ | 86.185 ± 0.005° |
| Cell volume | 1127.7 ± 0.7 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0978 |
| Residual factor for significantly intense reflections | 0.0682 |
| Weighted residual factors for significantly intense reflections | 0.2072 |
| Weighted residual factors for all reflections included in the refinement | 0.2357 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181300 (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 2/23/78. |
2237841.cif 2237841.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. |
2237841.cif 2237841.hkl |
| 88055 | 2013-08-28 | cod/cif/ (saulius@koala.ibt.lt) Adding the _cod_database_fobs_code links for those COD CIFs that have their Fobs deposited recently. |
2237841.cif 2237841.hkl |
| 88054 | 2013-08-28 | cod/hkl/ (saulius@koala.ibt.lt) Adding Fobs files for the recently deposited IUCr coordinate data. |
2237841.cif 2237841.hkl |
| 86517 | 2013-07-11 | cif/ Adding structures of 2237841 via cif-deposit CGI script. |
2237841.cif |
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Users of the data should acknowledge the original authors of the
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