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Information card for entry 4034025
Preview
| Coordinates | 4034025.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H54 Cd N12 O8 |
|---|---|
| Calculated formula | C32 H54 Cd N12 O8 |
| Title of publication | Two-Step Transformation of Aliphatic Polyketones into π-Conjugated Polyimines. |
| Authors of publication | Manabe, Yumehiro; Uesaka, Mitsuharu; Yoneda, Tomoki; Inokuma, Yasuhide |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2019 |
| Journal volume | 84 |
| Journal issue | 16 |
| Pages of publication | 9957 - 9964 |
| a | 15.0815 ± 0.0018 Å |
| b | 15.0815 ± 0.0018 Å |
| c | 8.9943 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2045.8 ± 0.4 Å3 |
| Cell temperature | 143 ± 2 K |
| Ambient diffraction temperature | 143 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 85 |
| Hermann-Mauguin space group symbol | P 4/n :2 |
| Hall space group symbol | -P 4a |
| Residual factor for all reflections | 0.0319 |
| Residual factor for significantly intense reflections | 0.0287 |
| Weighted residual factors for significantly intense reflections | 0.0699 |
| Weighted residual factors for all reflections included in the refinement | 0.0713 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 222585 (current) | 2019-11-04 | cif/ Adding structures of 4034025 via cif-deposit CGI script. |
4034025.cif |
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Users of the data should acknowledge the original authors of the
structural data.