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Information card for entry 7207934
Preview
| Coordinates | 7207934.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C56 H36 N6 |
|---|---|
| Calculated formula | C56 H36 N6 |
| SMILES | c12c(n(c3ccccc13)c1ccc(cc1)n1c3ccccc3nc1c1ccccc1)cc1c(c2)n(c2ccccc12)c1ccc(n2c3ccccc3nc2c2ccccc2)cc1 |
| Title of publication | Indolo[3,2-b]carbazole/benzimidazole hybrid bipolar host materials for highly efficient red, yellow, and green phosphorescent organic light emitting diodes |
| Authors of publication | Ting, Hao-Chun; Chen, You-Ming; You, Hong-Wei; Hung, Wen-Yi; Lin, Sheng-Hsun; Chaskar, Atul; Chou, Shu-Hua; Chi, Yun; Liu, Rai-Hsung; Wong, Ken-Tsung |
| Journal of publication | Journal of Materials Chemistry |
| Year of publication | 2012 |
| Journal volume | 22 |
| Journal issue | 17 |
| Pages of publication | 8399 |
| a | 9.3415 ± 0.0006 Å |
| b | 10.0537 ± 0.0007 Å |
| c | 11.5245 ± 0.0009 Å |
| α | 106.117 ± 0.007° |
| β | 99.662 ± 0.006° |
| γ | 93.529 ± 0.005° |
| Cell volume | 1018.35 ± 0.13 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0617 |
| Residual factor for significantly intense reflections | 0.047 |
| Weighted residual factors for significantly intense reflections | 0.1332 |
| Weighted residual factors for all reflections included in the refinement | 0.1538 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301863 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/20/ Each referenced PubChem compound corresponds to the full crystal structure. |
7207934.cif |
| 180410 | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/79. |
7207934.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7207934.cif |
| 56050 | 2012-05-08 | cif/ Adding structures of 7207933, 7207934 via cif-deposit CGI script. |
7207934.cif |
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