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Information card for entry 7116738
Preview
Coordinates | 7116738.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C9 H8 B2 K2 N6 O |
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Calculated formula | C9 H8 B2 K2 N6 O |
Title of publication | Convenient access to the tricyanoborate dianion B(CN)3^2-^ and selected reactions as a boron-centred nucleophile |
Authors of publication | Johannes Landmann; Jan A. P. Sprenger; Rudiger Bertermann; Nikolai Ignatiev; Vera Bernhardt-Pitchougina; Eduard Bernhardt; Helge Willner; Maik Finze |
Journal of publication | Chem.Commun. |
Year of publication | 2015 |
Journal volume | 51 |
Pages of publication | 4989 |
a | 9.8586 ± 0.0005 Å |
b | 13.1307 ± 0.0006 Å |
c | 12.1811 ± 0.0006 Å |
α | 90° |
β | 93.991 ± 0.002° |
γ | 90° |
Cell volume | 1573.02 ± 0.13 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0228 |
Residual factor for significantly intense reflections | 0.0201 |
Weighted residual factors for significantly intense reflections | 0.0536 |
Weighted residual factors for all reflections included in the refinement | 0.0549 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7116738.html
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Users of the data should acknowledge the original authors of the
structural data.