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Information card for entry 4037500
Preview
| Coordinates | 4037500.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C50 H18 B2 Cl6 F20 N2 O2 |
|---|---|
| Calculated formula | C50 H18 B2 Cl6 F20 N2 O2 |
| Title of publication | Highly Fluorescent Red-Light Emitting Bis(boranils) Based on Naphthalene Backbone. |
| Authors of publication | Urban, Mateusz; Durka, Krzysztof; Jankowski, Piotr; Serwatowski, Janusz; Luliński, Sergiusz |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2017 |
| Journal volume | 82 |
| Journal issue | 15 |
| Pages of publication | 8234 - 8241 |
| a | 14.8183 ± 0.0013 Å |
| b | 11.2475 ± 0.0002 Å |
| c | 15.815 ± 0.003 Å |
| α | 90° |
| β | 105.57 ± 0.02° |
| γ | 90° |
| Cell volume | 2539.1 ± 0.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0454 |
| Residual factor for significantly intense reflections | 0.0424 |
| Weighted residual factors for significantly intense reflections | 0.1099 |
| Weighted residual factors for all reflections included in the refinement | 0.113 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 236256 (current) | 2019-11-24 | cif/ Adding structures of 4037500, 4037501 via cif-deposit CGI script. |
4037500.cif |
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Users of the data should acknowledge the original authors of the
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