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Information card for entry 4518770
Preview
| Coordinates | 4518770.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C48 H84 Ca2 N8 |
|---|---|
| Calculated formula | C48 H84 Ca2 N8 |
| Title of publication | Organocalcium Complex-Catalyzed Selective Redistribution of ArSiH3 or Ar(alkyl)SiH2 to Ar3SiH or Ar2(alkyl)SiH |
| Authors of publication | Li, Tao; McCabe, Karl N.; Maron, Laurent; Leng, Xuebing; Chen, Yaofeng |
| Journal of publication | ACS Catalysis |
| Year of publication | 2021 |
| Pages of publication | 6348 - 6356 |
| a | 19.5031 ± 0.0005 Å |
| b | 49.3831 ± 0.0015 Å |
| c | 13.0859 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 12603.3 ± 0.6 Å3 |
| Cell temperature | 170 ± 2 K |
| Ambient diffraction temperature | 170.04 K |
| Number of distinct elements | 4 |
| Space group number | 43 |
| Hermann-Mauguin space group symbol | F d d 2 |
| Hall space group symbol | F 2 -2d |
| Residual factor for all reflections | 0.0633 |
| Residual factor for significantly intense reflections | 0.0478 |
| Weighted residual factors for significantly intense reflections | 0.1194 |
| Weighted residual factors for all reflections included in the refinement | 0.1313 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265730 (current) | 2021-06-03 | cif/ Adding structures of 4518770 via cif-deposit CGI script. |
4518770.cif |
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Users of the data should acknowledge the original authors of the
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