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Information card for entry 1571512
Preview
| Coordinates | 1571512.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 21152z |
|---|---|
| Formula | C32.5 H32.5 Cl1.5 O9 Si |
| Calculated formula | C32.5 H32.5 Cl1.5 O9 Si |
| Title of publication | Cascade reactions of HDDA-benzynes with tethered cyclohexadienones: strain-driven events originating from <i>ortho</i>-annulated benzocyclobutenes. |
| Authors of publication | Chinta, Bhavani Shankar; Sneddon, Dorian S.; Hoye, Thomas R. |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 21 |
| Pages of publication | 8181 - 8189 |
| a | 9.514 ± 0.002 Å |
| b | 12.361 ± 0.003 Å |
| c | 13.998 ± 0.004 Å |
| α | 76.32 ± 0.012° |
| β | 77.845 ± 0.008° |
| γ | 79.645 ± 0.009° |
| Cell volume | 1548.9 ± 0.7 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.1567 |
| Residual factor for significantly intense reflections | 0.1068 |
| Weighted residual factors for significantly intense reflections | 0.2893 |
| Weighted residual factors for all reflections included in the refinement | 0.3364 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 292929 (current) | 2024-07-05 | cif/ Updating files of 1571511, 1571512, 1571513, 1571514 Original log message: Adding full bibliography for 1571511--1571514.cif. |
1571512.cif |
| 291421 | 2024-05-01 | cif/ Adding structures of 1571511, 1571512, 1571513, 1571514 via cif-deposit CGI script. |
1571512.cif |
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Users of the data should acknowledge the original authors of the
structural data.