Information card for entry 4064674
| Formula |
C56 H38 Ge O2 |
| Calculated formula |
C56 H38 Ge O2 |
| SMILES |
C1(=C(c2ccccc2)C(=C([Ge]1(C#Cc1ccc(cc1)Oc1ccccc1)C#Cc1ccc(cc1)Oc1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1 |
| Title of publication |
Synthesis, Characterization, and Crystal Structures of 1,1-Disubstituted-2,3,4,5-tetraphenylgermoles That Exhibit Aggregation-Induced Emission |
| Authors of publication |
Bandrowsky, Teresa L.; Carroll, James B.; Braddock-Wilking, Janet |
| Journal of publication |
Organometallics |
| Year of publication |
2011 |
| Journal volume |
30 |
| Journal issue |
13 |
| Pages of publication |
3559 |
| a |
24.2228 ± 0.0002 Å |
| b |
10.2163 ± 0.0001 Å |
| c |
16.7527 ± 0.0002 Å |
| α |
90° |
| β |
98.971 ± 0.001° |
| γ |
90° |
| Cell volume |
4095.03 ± 0.07 Å3 |
| Cell temperature |
293 K |
| Ambient diffraction temperature |
293 K |
| Number of distinct elements |
4 |
| Space group number |
15 |
| Hermann-Mauguin space group symbol |
C 1 2/c 1 |
| Hall space group symbol |
-C 2yc |
| Residual factor for all reflections |
0.0397 |
| Residual factor for significantly intense reflections |
0.0314 |
| Weighted residual factors for all reflections |
0.0827 |
| Weighted residual factors for significantly intense reflections |
0.0756 |
| Weighted residual factors for all reflections included in the refinement |
0.0827 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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