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Information card for entry 7235284
Preview
| Coordinates | 7235284.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C26 H23 Br N2 O3 |
|---|---|
| Calculated formula | C26 H23 Br N2 O3 |
| Title of publication | Design, synthesis and antitumor activity of novel 8-substituted 2,3,5,6-tetrahydrobenzo[1,2-b:4,5-b′]difuran imidazolium salt derivatives |
| Authors of publication | Sun, Cheng-Jun; Chen, Wen; Li, Yan; Liu, Lan-Xiang; Wang, Xue-Quan; Li, Li-Juan; Zhang, Hong-Bin; Yang, Xiao-Dong |
| Journal of publication | RSC Adv. |
| Year of publication | 2014 |
| Journal volume | 4 |
| Journal issue | 31 |
| Pages of publication | 16312 |
| a | 9.8296 ± 0.0015 Å |
| b | 10.2016 ± 0.0016 Å |
| c | 12.6394 ± 0.0019 Å |
| α | 78.083 ± 0.002° |
| β | 70.581 ± 0.002° |
| γ | 70.89 ± 0.002° |
| Cell volume | 1122.7 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1095 |
| Residual factor for significantly intense reflections | 0.0596 |
| Weighted residual factors for significantly intense reflections | 0.1702 |
| Weighted residual factors for all reflections included in the refinement | 0.2265 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.929 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7235284.cif |
| 232650 | 2019-11-23 | cif/ Adding structures of 7235284 via cif-deposit CGI script. |
7235284.cif |
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Users of the data should acknowledge the original authors of the
structural data.