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Information card for entry 4515599
Preview
| Coordinates | 4515599.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C51 H86 N6 O2 Zn2 |
|---|---|
| Calculated formula | C51 H86 N6 O2 Zn2 |
| Title of publication | Side Arm Twist on Zn-Catalyzed Hydrosilylative Reduction of CO2 to Formate and Methanol Equivalents with High Selectivity and Activity |
| Authors of publication | Feng, Guoqin; Du, Chongyang; Xiang, Li; del Rosal, Iker; Li, Guangyu; Leng, Xuebing; Chen, Eugene Y.-X.; Maron, Laurent; Chen, Yaofeng |
| Journal of publication | ACS Catalysis |
| Year of publication | 2018 |
| Journal volume | 8 |
| Journal issue | 5 |
| Pages of publication | 4710 |
| a | 16.1366 ± 0.0003 Å |
| b | 16.5978 ± 0.0003 Å |
| c | 23.3164 ± 0.0004 Å |
| α | 98.9 ± 0.001° |
| β | 90.984 ± 0.001° |
| γ | 119.052 ± 0.001° |
| Cell volume | 5362.53 ± 0.18 Å3 |
| Cell temperature | 170 ± 2 K |
| Ambient diffraction temperature | 170 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 | 0.0559 |
| Residual factor for significantly intense reflections | 0.0496 |
| Weighted residual factors for significantly intense reflections | 0.132 |
| Weighted residual factors for all reflections included in the refinement | 0.138 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 225744 (current) | 2019-11-10 | cif/ Adding structures of 4515594, 4515595, 4515596, 4515597, 4515598, 4515599, 4515600 via cif-deposit CGI script. |
4515599.cif |
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Users of the data should acknowledge the original authors of the
structural data.