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Information card for entry 7117852
Preview
| Coordinates | 7117852.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 10 in manuscript |
|---|---|
| Formula | C28 H48 N4 S Si2 |
| Calculated formula | C28 H48 N4 S Si2 |
| Title of publication | Bisalkynylated 3,6-diiminocyclohexa-1,4-diene-1,4-diamine |
| Authors of publication | Philipp Biegger; Manuel Schaffroth; Kerstin Brodner; Olena Tverskoy; Frank Rominger; Uwe H. F. Bunz |
| Journal of publication | Chem.Commun. |
| Year of publication | 2015 |
| Journal volume | 51 |
| Pages of publication | 14844 |
| a | 15.4408 ± 0.0014 Å |
| b | 13.9268 ± 0.0012 Å |
| c | 14.8221 ± 0.0013 Å |
| α | 90° |
| β | 103.112 ± 0.003° |
| γ | 90° |
| Cell volume | 3104.3 ± 0.5 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0834 |
| Residual factor for significantly intense reflections | 0.0545 |
| Weighted residual factors for significantly intense reflections | 0.1074 |
| Weighted residual factors for all reflections included in the refinement | 0.1235 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 158308 (current) | 2015-09-25 | cif/ Adding structures of 7117848, 7117849, 7117850, 7117851, 7117852, 7117853, 7117854 via cif-deposit CGI script. |
7117852.cif |
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Users of the data should acknowledge the original authors of the
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