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Information card for entry 1559580
Preview
Coordinates | 1559580.cif |
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Original paper (by DOI) | HTML |
Formula | C50 H59 Au B N3 |
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Calculated formula | C50 H59 Au B N3 |
SMILES | [Au](=C1N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)C(B(c1c(cccc1)C)c1c(cccc1)C)=Nc1c(cccc1C)C |
Title of publication | Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. |
Authors of publication | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto |
Journal of publication | Chemical science |
Year of publication | 2020 |
Journal volume | 12 |
Journal issue | 3 |
Pages of publication | 917 - 928 |
a | 12.3065 ± 0.0001 Å |
b | 17.99 ± 0.0002 Å |
c | 20.3257 ± 0.0002 Å |
α | 83.34 ± 0.001° |
β | 79.742 ± 0.001° |
γ | 83.084 ± 0.001° |
Cell volume | 4375.21 ± 0.08 Å3 |
Cell temperature | 93 ± 2 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.052 |
Residual factor for significantly intense reflections | 0.0317 |
Weighted residual factors for significantly intense reflections | 0.0559 |
Weighted residual factors for all reflections included in the refinement | 0.0595 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1559580.html
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