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Information card for entry 8107252
Preview
| Coordinates | 8107252.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H30 N4 O8 |
|---|---|
| Calculated formula | C32 H30 N4 O8 |
| Title of publication | Crystal structure of 5,5′-(1,4-phenylene)bis(1H-imidazol-3-ium) bis(2-(2-(carboxymethyl)phenyl)acetate), C32H30N4O8 |
| Authors of publication | Lu, Zhi-Qiang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2022 |
| Journal volume | 237 |
| Journal issue | 5 |
| Pages of publication | 921 - 922 |
| a | 9.4698 ± 0.001 Å |
| b | 10.9797 ± 0.0012 Å |
| c | 14.0366 ± 0.0015 Å |
| α | 90° |
| β | 96.807 ± 0.001° |
| γ | 90° |
| Cell volume | 1449.2 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0526 |
| Residual factor for significantly intense reflections | 0.0392 |
| Weighted residual factors for significantly intense reflections | 0.1032 |
| Weighted residual factors for all reflections included in the refinement | 0.1087 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 283958 (current) | 2023-05-23 | cif/ Adding structures of 8107252 via cif-deposit CGI script. |
8107252.cif |
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Users of the data should acknowledge the original authors of the
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