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Information card for entry 4120547
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Coordinates | 4120547.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C90 H118 S6 |
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Calculated formula | C90 H118 S6 |
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 | 13.536 ± 0.003 Å |
b | 13.731 ± 0.003 Å |
c | 13.837 ± 0.003 Å |
α | 117.032 ± 0.002° |
β | 106.648 ± 0.002° |
γ | 95.35 ± 0.002° |
Cell volume | 2118.2 ± 0.8 Å3 |
Cell temperature | 173 K |
Ambient diffraction temperature | 173 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 | 0.0981 |
Weighted residual factors for all reflections included in the refinement | 0.3164 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4120547.html
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