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Information card for entry 1559586
Preview
| Coordinates | 1559586.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C63 H78 Au B N4 O |
|---|---|
| Calculated formula | C63 H78 Au B N4 O |
| SMILES | [Au](=C1N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)C1N(/C(=N/c2c(cccc2C)C)[B]=1(c1c(cccc1)C)c1c(cccc1)C)c1c(cccc1C)C.CCOCC |
| 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 | 13.6039 ± 0.0002 Å |
| b | 23.0648 ± 0.0003 Å |
| c | 18.7378 ± 0.0003 Å |
| α | 90° |
| β | 105.489 ± 0.002° |
| γ | 90° |
| Cell volume | 5665.85 ± 0.15 Å3 |
| Cell temperature | 93 ± 2 K |
| Ambient diffraction temperature | 93 ± 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 | 0.0543 |
| Residual factor for significantly intense reflections | 0.0344 |
| Weighted residual factors for significantly intense reflections | 0.0631 |
| Weighted residual factors for all reflections included in the refinement | 0.0675 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 267095 (current) | 2021-07-05 | cif/ Updating files of 1559577, 1559578, 1559579, 1559580, 1559581, 1559582, 1559583, 1559584, 1559585, 1559586, 1559587 Original log message: Adding full bibliography for 1559577--1559587.cif. |
1559586.cif |
| 261580 | 2021-02-05 | cif/ Updating files of 1559577, 1559578, 1559579, 1559580, 1559581, 1559582, 1559583, 1559584, 1559585, 1559586, 1559587 Original log message: Adding full bibliography for 1559577--1559587.cif. |
1559586.cif |
| 259329 | 2020-11-30 | cif/ Adding structures of 1559577, 1559578, 1559579, 1559580, 1559581, 1559582, 1559583, 1559584, 1559585, 1559586, 1559587 via cif-deposit CGI script. |
1559586.cif |
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Users of the data should acknowledge the original authors of the
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