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Information card for entry 4132270
Preview
| Coordinates | 4132270.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C94 H80 Cl4 N8 |
|---|---|
| Calculated formula | C94 H80 Cl4 N8 |
| Title of publication | Hash-Mark-Shaped Azaacene Tetramers with Axial Chirality. |
| Authors of publication | Inoue, Yuki; Sakamaki, Daisuke; Tsutsui, Yusuke; Gon, Masayuki; Chujo, Yoshiki; Seki, Shu |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2018 |
| Journal volume | 140 |
| Journal issue | 23 |
| Pages of publication | 7152 - 7158 |
| a | 31.014 ± 0.009 Å |
| b | 15.951 ± 0.004 Å |
| c | 15.969 ± 0.004 Å |
| α | 90° |
| β | 103.327 ± 0.005° |
| γ | 90° |
| Cell volume | 7687 ± 4 Å3 |
| Cell temperature | 143 K |
| Ambient diffraction temperature | 143 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 | 0.1258 |
| Residual factor for significantly intense reflections | 0.1012 |
| Weighted residual factors for significantly intense reflections | 0.3151 |
| Weighted residual factors for all reflections included in the refinement | 0.3423 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.222 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 242266 (current) | 2019-11-26 | cif/ Adding structures of 4132270 via cif-deposit CGI script. |
4132270.cif |
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Users of the data should acknowledge the original authors of the
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