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Information card for entry 4514010
Preview
| Coordinates | 4514010.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C54 H46 Al F15 N3 O Re |
|---|---|
| Calculated formula | C54 H46 Al F15 N3 O Re |
| Title of publication | Tuning Catalytic Activity in the Hydrogenation of Unactivated Olefins with Transition-Metal Oxos as the Lewis Base Component of Frustrated Lewis Pairs |
| Authors of publication | Lambic, Nikola S.; Sommer, Roger D.; Ison, Elon A. |
| Journal of publication | ACS Catalysis |
| Year of publication | 2017 |
| Journal volume | 7 |
| Journal issue | 2 |
| Pages of publication | 1170 |
| a | 12.546 ± 0.003 Å |
| b | 14.078 ± 0.003 Å |
| c | 17.037 ± 0.005 Å |
| α | 67.591 ± 0.01° |
| β | 72.379 ± 0.009° |
| γ | 69.555 ± 0.009° |
| Cell volume | 2556.2 ± 1.1 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0528 |
| Residual factor for significantly intense reflections | 0.0481 |
| Weighted residual factors for significantly intense reflections | 0.1268 |
| Weighted residual factors for all reflections included in the refinement | 0.1301 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.1 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 191225 (current) | 2017-02-03 | cif/ Adding structures of 4514010 via cif-deposit CGI script. |
4514010.cif |
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