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Information card for entry 4038409
Preview
| Coordinates | 4038409.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C31 H54 B F4 N4 P |
|---|---|
| Calculated formula | C31 H54 B F4 N4 P |
| Title of publication | Cyclopropenylidenephosphoranes: Rearrangement to Azetidinylidene-Methylphosphoniums. |
| Authors of publication | Mboyi, Clève Dionel; Poater, Albert; Poater, Jordi; Duhayon, Carine; Chauvin, Remi |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2020 |
| a | 14.3278 ± 0.0008 Å |
| b | 16.401 ± 0.0009 Å |
| c | 28.7615 ± 0.0016 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 6758.7 ± 0.6 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 6 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0828 |
| Residual factor for significantly intense reflections | 0.0575 |
| Weighted residual factors for all reflections | 0.0627 |
| Weighted residual factors for significantly intense reflections | 0.0477 |
| Weighted residual factors for all reflections included in the refinement | 0.0437 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.102 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 252362 (current) | 2020-05-27 | cif/ Adding structures of 4038409 via cif-deposit CGI script. |
4038409.cif |
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Users of the data should acknowledge the original authors of the
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