Information card for entry 4120548
| Formula |
C126 H168 S9 |
| Calculated formula |
C126 H168.01 S9 |
| Title of publication |
Multifunctional π-Expanded Macrocyclic Oligothiophene 6-Mers and Related Macrocyclic Oligomers. |
| Authors of publication |
Iyoda, Masahiko; Tanaka, Keita; Shimizu, Hideyuki; Hasegawa, Masashi; Nishinaga, Tohru; Nishiuchi, Tomohiko; Kunugi, Yoshihito; Ishida, Takayuki; Otani, Hiroyuki; Sato, Hiroyasu; Inukai, Koji; Tahara, Kazukuni; Tobe, Yoshito |
| Journal of publication |
Journal of the American Chemical Society |
| Year of publication |
2014 |
| Journal volume |
136 |
| Journal issue |
6 |
| Pages of publication |
2389 - 2396 |
| a |
14.5307 ± 0.0013 Å |
| b |
16.0648 ± 0.0014 Å |
| c |
26.561 ± 0.002 Å |
| α |
99.03 ± 0.007° |
| β |
90.771 ± 0.006° |
| γ |
107.277 ± 0.008° |
| Cell volume |
5835.2 ± 0.9 Å3 |
| Cell temperature |
93 K |
| Ambient diffraction temperature |
93 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 significantly intense reflections |
0.236 |
| Weighted residual factors for all reflections included in the refinement |
0.5506 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.591 |
| Diffraction radiation wavelength |
1.54187 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/4120548.html
