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Information card for entry 7160511
Preview
Coordinates | 7160511.cif |
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Original paper (by DOI) | HTML |
Chemical name | dimethyl (Z)-2-(1-benzamido-2-oxo-2-phenylethylidene)succinate |
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Formula | C21 H19 N O6 |
Calculated formula | C21 H19 N O6 |
Title of publication | Hydrogen-bonding-controlled stereospecific synthesis of <i>Z</i>-enamides. |
Authors of publication | Zhang, Xiaoyu; Lu, Xiangyu; Zou, Yajun; Lang, JiaJia; Wang, Yingwei; Zhao, Gang |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2025 |
Journal volume | 23 |
Journal issue | 20 |
Pages of publication | 4884 - 4887 |
a | 5.6083 ± 0.0015 Å |
b | 12.004 ± 0.004 Å |
c | 14.983 ± 0.005 Å |
α | 78.692 ± 0.011° |
β | 84.933 ± 0.01° |
γ | 79.177 ± 0.01° |
Cell volume | 970.1 ± 0.5 Å3 |
Cell temperature | 213 ± 2 K |
Ambient diffraction temperature | 213 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1213 |
Residual factor for significantly intense reflections | 0.0637 |
Weighted residual factors for significantly intense reflections | 0.1497 |
Weighted residual factors for all reflections included in the refinement | 0.1903 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
301144 (current) | 2025-07-06 | cif/ Updating files of 7160511, 7160512 Original log message: Adding full bibliography for 7160511--7160512.cif. |
7160511.cif |
299377 | 2025-04-24 | cif/ Adding structures of 7160511, 7160512 via cif-deposit CGI script. |
7160511.cif |
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