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Information card for entry 7159246
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Coordinates | 7159246.cif |
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Original paper (by DOI) | HTML |
Chemical name | 2-((2,5-dioxo-4-phenyl-2,5-dihydro-1H-pyrrol-3-yl)amino)benzoic acid |
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Formula | C19 H18 N2 O5 S |
Calculated formula | C19 H18 N2 O5 S |
Title of publication | Synthesis of 2-carboxyaniline-substituted maleimides from 2'-nitrochalcones. |
Authors of publication | Aksenov, Nicolai A.; Aksenov, Dmitrii A.; Ganusenko, Daniil D.; Kurenkov, Igor A.; Leontiev, Alexander V.; Aksenov, Alexander V. |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2023 |
Journal volume | 21 |
Journal issue | 15 |
Pages of publication | 3156 - 3166 |
a | 9.711 ± 0.0001 Å |
b | 8.912 ± 0.0001 Å |
c | 20.7791 ± 0.0002 Å |
α | 90° |
β | 99.215 ± 0.001° |
γ | 90° |
Cell volume | 1775.11 ± 0.03 Å3 |
Cell temperature | 100.01 ± 0.1 K |
Ambient diffraction temperature | 100.01 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0403 |
Residual factor for significantly intense reflections | 0.0393 |
Weighted residual factors for significantly intense reflections | 0.1051 |
Weighted residual factors for all reflections included in the refinement | 0.1059 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | synchrotron |
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/7159246.html
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