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Information card for entry 7159307
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Coordinates | 7159307.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H16 N2 S |
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Calculated formula | C20 H16 N2 S |
Title of publication | One-pot synthesis of 11-sulfenyl dibenzodiazepines <i>via</i> tandem sulfenylation/cyclization of <i>o</i>-isocyanodiaryl amines and diaryl disulfides. |
Authors of publication | Liu, Yi; Gao, Wei; Yuan, Sitian; Ni, Mengjia; Hao, Tianxin; Zeng, Cuiying; Xu, Xinyi; Fu, Yang; Peng, Yiyuan; Ding, Qiuping |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2023 |
Journal volume | 21 |
Journal issue | 20 |
Pages of publication | 4257 - 4263 |
a | 8.3581 ± 0.0007 Å |
b | 15.8178 ± 0.0011 Å |
c | 24.7199 ± 0.0017 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3268.1 ± 0.4 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 4 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0881 |
Residual factor for significantly intense reflections | 0.0529 |
Weighted residual factors for significantly intense reflections | 0.1131 |
Weighted residual factors for all reflections included in the refinement | 0.1286 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
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/7159307.html
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