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Information card for entry 1501681
Preview
| Coordinates | 1501681.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C196 H128 Cl8 |
|---|---|
| Calculated formula | C196 H128 Cl8 |
| SMILES | ClCCl.c1(c2cc(cc(c3c4c(cc5c3cccc5)cccc4)c2)c2c3c(cc4c2cccc4)cccc3)c2c(cc3c1cccc3)cccc2 |
| Title of publication | Novel Deep Blue OLED Emitters with 1,3,5-Tri(anthracen-10-yl)benzene-Centered Starburst Oligofluorenes |
| Authors of publication | Huang, Hong; Fu, Qiang; Zhuang, Shaoqing; Liu, Yakun; Wang, Lei; Chen, Jiangshan; Ma, Dongge; Yang, Chuluo |
| Journal of publication | The Journal of Physical Chemistry C |
| Year of publication | 2011 |
| Journal volume | 115 |
| Journal issue | 11 |
| Pages of publication | 4872 |
| a | 11.849 ± 0.003 Å |
| b | 17.35 ± 0.005 Å |
| c | 21.055 ± 0.004 Å |
| α | 90° |
| β | 121.146 ± 0.011° |
| γ | 90° |
| Cell volume | 3704.5 ± 1.6 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1263 |
| Residual factor for significantly intense reflections | 0.1121 |
| Weighted residual factors for significantly intense reflections | 0.2491 |
| Weighted residual factors for all reflections included in the refinement | 0.2583 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.159 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1501681.cif |
| 91932 | 2013-12-28 | cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs. |
1501681.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
1501681.cif |
| 35033 | 2012-02-26 | ../uploads/cif-deposit/cod/cif Adding structures of 1501681 via cif-deposit CGI script. |
1501681.cif |
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Users of the data should acknowledge the original authors of the
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