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Information card for entry 8107694
Preview
| Coordinates | 8107694.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C44 H52 N4 O12 |
|---|---|
| Calculated formula | C44 H52 N4 O12 |
| Title of publication | Crystal structure of N-cyclopropyl-3-hydroxy-4-methoxybenzamide, C11H13NO3 |
| Authors of publication | Tong, Hongjuan; Xu, Xiaona; Zhu, Zhoujing; Liu, Bin |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2023 |
| Journal volume | 238 |
| Journal issue | 6 |
| Pages of publication | 1175 - 1176 |
| a | 8.0478 ± 0.0003 Å |
| b | 9.8093 ± 0.0004 Å |
| c | 13.1602 ± 0.0005 Å |
| α | 90° |
| β | 104.712 ± 0.002° |
| γ | 90° |
| Cell volume | 1004.85 ± 0.07 Å3 |
| Cell temperature | 170 K |
| Ambient diffraction temperature | 170 K |
| Number of distinct elements | 4 |
| 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 | 0.0545 |
| Residual factor for significantly intense reflections | 0.0395 |
| Weighted residual factors for significantly intense reflections | 0.0901 |
| Weighted residual factors for all reflections included in the refinement | 0.101 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287832 (current) | 2023-11-28 | cif/ Adding structures of 8107694 via cif-deposit CGI script. |
8107694.cif |
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Users of the data should acknowledge the original authors of the
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