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Information card for entry 7122454
Preview
Coordinates | 7122454.cif |
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Original paper (by DOI) | HTML |
Formula | C18 H20 I N3 O2 |
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Calculated formula | C18 H20 I N3 O2 |
Title of publication | Catalytic enantioselective ene-type reactions of vinylogous hydrazone: construction of α-methylene-γ-butyrolactone derivatives. |
Authors of publication | Zhang, Hang; Yao, Qian; Cao, Weidi; Ge, Shulin; Xu, Jinxiu; Liu, Xiaohua; Feng, Xiaoming |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2018 |
Journal volume | 54 |
Journal issue | 88 |
Pages of publication | 12511 - 12514 |
a | 6.5952 ± 0.0003 Å |
b | 8.1944 ± 0.0003 Å |
c | 34.4405 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1861.29 ± 0.12 Å3 |
Cell temperature | 294.2 ± 0.2 K |
Ambient diffraction temperature | 294.2 ± 0.2 K |
Number of distinct elements | 5 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0779 |
Residual factor for significantly intense reflections | 0.0722 |
Weighted residual factors for significantly intense reflections | 0.1912 |
Weighted residual factors for all reflections included in the refinement | 0.2003 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
228198 (current) | 2019-11-17 | cif/ Updating files of 7122454, 7122455, 7122456, 7122457 Original log message: Adding full bibliography for 7122454--7122457.cif. |
7122454.cif |
211463 | 2018-10-14 | cif/ Adding structures of 7122454, 7122455, 7122456, 7122457 via cif-deposit CGI script. |
7122454.cif |
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Users of the data should acknowledge the original authors of the
structural data.