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Information card for entry 1555384
Preview
| Coordinates | 1555384.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H32 B2 F4 N4 |
|---|---|
| Calculated formula | C30 H32 B2 F4 N4 |
| Title of publication | Conformation-Restricted Partially and Fully Fused BODIPY Dimers as Highly Stable Near-Infrared Fluorescent Dyes. |
| Authors of publication | Wang, Jun; Wu, Qinghua; Wang, Shaowu; Yu, Changjiang; Li, Jin; Hao, Erhong; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan |
| Journal of publication | Organic letters |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 21 |
| Pages of publication | 5360 - 5363 |
| a | 12.718 ± 0.002 Å |
| b | 8.6639 ± 0.0016 Å |
| c | 12.342 ± 0.002 Å |
| α | 90° |
| β | 101.101 ± 0.003° |
| γ | 90° |
| Cell volume | 1334.5 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293.15 K |
| Number of distinct elements | 5 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.1728 |
| Residual factor for significantly intense reflections | 0.0614 |
| Weighted residual factors for significantly intense reflections | 0.1313 |
| Weighted residual factors for all reflections included in the refinement | 0.1804 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.981 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238591 (current) | 2019-11-24 | cif/ Adding structures of 1555384, 1555385 via cif-deposit CGI script. |
1555384.cif |
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Users of the data should acknowledge the original authors of the
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