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Information card for entry 8104622
Preview
| Coordinates | 8104622.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H22 N2 O2 |
|---|---|
| Calculated formula | C25 H22 N2 O2 |
| Title of publication | The crystal structure of 1,2-bis(4-pyridyl)ethane - 4,4-dihydroxydiphenylmethane (1/1), C25H21N2O2 |
| Authors of publication | Cheng, Jie; Chen, Jue |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 5 |
| Pages of publication | 915 - 917 |
| a | 11.041 ± 0.002 Å |
| b | 7.8592 ± 0.0016 Å |
| c | 24.131 ± 0.005 Å |
| α | 90° |
| β | 95.26 ± 0.03° |
| γ | 90° |
| Cell volume | 2085.1 ± 0.7 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.086 |
| Residual factor for significantly intense reflections | 0.0486 |
| Weighted residual factors for significantly intense reflections | 0.1196 |
| Weighted residual factors for all reflections included in the refinement | 0.1402 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273323 (current) | 2022-03-04 | cif/ Adding structures of 8104622 via cif-deposit CGI script. |
8104622.cif |
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Users of the data should acknowledge the original authors of the
structural data.