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Information card for entry 7124081
Preview
| Coordinates | 7124081.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C15 H21 N O Si |
|---|---|
| Calculated formula | C15 H21 N O Si |
| Title of publication | Si-coumarin of hydrogen-bonding induced bathochromic effect for monitoring adipogenic differentiation |
| Authors of publication | Li, Chen; Wang, Ting; Li, Ni; Li, Min; Li, Yuntao; Sun, Yan; Tian, Yang; Zhu, Junru; Wu, Yiqian; Zhang, Dazhi; Cui, Xiaoyan |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 9.9331 ± 0.0002 Å |
| b | 7.244 ± 0.0001 Å |
| c | 10.5483 ± 0.0002 Å |
| α | 90° |
| β | 108.156 ± 0.002° |
| γ | 90° |
| Cell volume | 721.22 ± 0.02 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0397 |
| Residual factor for significantly intense reflections | 0.0394 |
| Weighted residual factors for significantly intense reflections | 0.1052 |
| Weighted residual factors for all reflections included in the refinement | 0.1054 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.073 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301860 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/12/ Each referenced PubChem compound corresponds to the full crystal structure. |
7124081.cif |
| 217848 | 2019-08-30 | cif/ Adding structures of 7124081 via cif-deposit CGI script. |
7124081.cif |
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Users of the data should acknowledge the original authors of the
structural data.