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Information card for entry 7128942
Preview
Coordinates | 7128942.cif |
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Original paper (by DOI) | HTML |
Formula | C15 H12 Cl N3 O2 S |
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Calculated formula | C15 H12 Cl N3 O2 S |
Title of publication | The azidosulfonylation of terminal alkynes leading to β-azidovinyl sulfones. |
Authors of publication | Zheng, Long; Wang, Zhanjing; Li, Chen; Wu, Yong; Liu, Zhaohong; Ning, Yongquan |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2021 |
Journal volume | 57 |
Journal issue | 77 |
Pages of publication | 9874 - 9877 |
a | 16.0974 ± 0.001 Å |
b | 11.1555 ± 0.0008 Å |
c | 17.8712 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3209.2 ± 0.4 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298.15 K |
Number of distinct elements | 6 |
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 | 0.126 |
Residual factor for significantly intense reflections | 0.0592 |
Weighted residual factors for significantly intense reflections | 0.131 |
Weighted residual factors for all reflections included in the refinement | 0.1603 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
269628 (current) | 2021-10-06 | cif/ Updating files of 7128942 Original log message: Adding full bibliography for 7128942.cif. |
7128942.cif |
269033 | 2021-09-08 | cif/ Adding structures of 7128942 via cif-deposit CGI script. |
7128942.cif |
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