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Information card for entry 7156853
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Coordinates | 7156853.cif |
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Original paper (by DOI) | HTML |
Formula | C17 H12 Br N3 O |
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Calculated formula | C17 H12 Br N3 O |
Title of publication | Chemodivergent reaction of azomethine imines and 2H-azirines for the synthesis of nitrogen-containing scaffolds. |
Authors of publication | Wu, Yufeng; Tian, Bing; Hu, Chao; Sekine, Kohei; Rudolph, Matthias; Rominger, Frank; Hashmi, A Stephen K |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2019 |
Journal volume | 17 |
Journal issue | 22 |
Pages of publication | 5505 - 5508 |
a | 21.9776 ± 0.0014 Å |
b | 8.2312 ± 0.0005 Å |
c | 15.9421 ± 0.0011 Å |
α | 90° |
β | 94.9609 ± 0.0012° |
γ | 90° |
Cell volume | 2873.2 ± 0.3 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0639 |
Residual factor for significantly intense reflections | 0.0372 |
Weighted residual factors for significantly intense reflections | 0.0774 |
Weighted residual factors for all reflections included in the refinement | 0.086 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
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/7156853.html
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