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Information card for entry 8105392
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Coordinates | 8105392.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H18 N4 O6 S |
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Calculated formula | C19 H18 N4 O6 S |
Title of publication | Crystal structure of 3-((3-nitrophenyl)sulfonamido)propanoic acid — 4,4′-bipyridine (1/1), C19H18N4O6S |
Authors of publication | Chen, Xiao-Miao; Liu, Zheng-Jun; Cheng, Jing-Song; Zhao, Rong-Fei; Qin, Lan |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2020 |
Journal volume | 235 |
Journal issue | 5 |
Pages of publication | 1109 - 1111 |
a | 8.343 ± 0.004 Å |
b | 7.367 ± 0.003 Å |
c | 31.532 ± 0.014 Å |
α | 90° |
β | 97.398 ± 0.008° |
γ | 90° |
Cell volume | 1921.9 ± 1.5 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296.15 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0584 |
Residual factor for significantly intense reflections | 0.042 |
Weighted residual factors for significantly intense reflections | 0.1084 |
Weighted residual factors for all reflections included in the refinement | 0.1158 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
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/8105392.html
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