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Information card for entry 7709942
Preview
| Coordinates | 7709942.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H19 B N2 Si |
|---|---|
| Calculated formula | C18 H19 B N2 Si |
| SMILES | B1(Nc2c3c(cccc3ccc2)N1)[Si](c1ccccc1)(C)C |
| Title of publication | A stable silylborane with diminished boron-Lewis acidity |
| Authors of publication | Yoshida, Hiroto; Izumi, Yuki; Hiraoka, Yuta; Nakanishi, Kazuki; Nakamoto, Masaaki; Hatano, Sayaka; Abe, Manabu |
| Journal of publication | Dalton Transactions |
| Year of publication | 2022 |
| a | 7.0647 ± 0.0016 Å |
| b | 11.425 ± 0.003 Å |
| c | 20.803 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1679.1 ± 0.7 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0397 |
| Residual factor for significantly intense reflections | 0.0332 |
| Weighted residual factors for significantly intense reflections | 0.0731 |
| Weighted residual factors for all reflections included in the refinement | 0.076 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274439 (current) | 2022-04-09 | cif/ Adding structures of 7709942 via cif-deposit CGI script. |
7709942.cif |
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Users of the data should acknowledge the original authors of the
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