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Information card for entry 1519498
Preview
| Coordinates | 1519498.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C41 H37 N O |
|---|---|
| Calculated formula | C41 H37 N O |
| SMILES | O=C(/C=C(NC1CCCCC1)/c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1)c1ccccc1 |
| Title of publication | Construction of regio- and stereoregular poly(enaminone)s by multicomponent tandem polymerizations of diynes, diaroyl chloride and primary amines |
| Authors of publication | Deng, Haiqin; Hu, Rongrong; Leung, Anakin C. S.; Zhao, Engui; Lam, Jacky W. Y.; Tang, Ben Zhong |
| Journal of publication | Polym. Chem. |
| Year of publication | 2015 |
| Journal volume | 6 |
| Journal issue | 24 |
| Pages of publication | 4436 |
| a | 9.8924 ± 0.0006 Å |
| b | 10.291 ± 0.0007 Å |
| c | 15.6015 ± 0.0006 Å |
| α | 91.437 ± 0.004° |
| β | 94.959 ± 0.004° |
| γ | 101.331 ± 0.005° |
| Cell volume | 1550.05 ± 0.16 Å3 |
| Cell temperature | 99.9 ± 0.3 K |
| Ambient diffraction temperature | 99.9 ± 0.3 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0546 |
| Residual factor for significantly intense reflections | 0.0453 |
| Weighted residual factors for significantly intense reflections | 0.12 |
| Weighted residual factors for all reflections included in the refinement | 0.127 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176428 (current) | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
1519498.cif |
| 143770 | 2015-07-11 | cif/ Updating files of 1519498 Original log message: Adding full bibliography for 1519498.cif. |
1519498.cif |
| 136075 | 2015-05-12 | cif/ Adding structures of 1519498 via cif-deposit CGI script. |
1519498.cif |
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Users of the data should acknowledge the original authors of the
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