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Information card for entry 4514024
Preview
| Coordinates | 4514024.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C94 H118 Ge2 N2 O Si2 |
|---|---|
| Calculated formula | C94 H118 Ge2 N2 O Si2 |
| Title of publication | Efficient Reduction of Carbon Dioxide to Methanol Equivalents Catalyzed by Two-Coordinate Amido–Germanium(II) and −Tin(II) Hydride Complexes |
| Authors of publication | Hadlington, Terrance J.; Kefalidis, Christos E.; Maron, Laurent; Jones, Cameron |
| Journal of publication | ACS Catalysis |
| Year of publication | 2017 |
| Journal volume | 7 |
| Journal issue | 3 |
| Pages of publication | 1853 |
| a | 24.283 ± 0.005 Å |
| b | 21.152 ± 0.004 Å |
| c | 17.759 ± 0.004 Å |
| α | 90° |
| β | 114.38 ± 0.03° |
| γ | 90° |
| Cell volume | 8308 ± 4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.086 |
| Residual factor for significantly intense reflections | 0.0695 |
| Weighted residual factors for significantly intense reflections | 0.196 |
| Weighted residual factors for all reflections included in the refinement | 0.2107 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
| Diffraction radiation wavelength | 0.7108 Å |
| Diffraction radiation type | Synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301843 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/51/ Each referenced PubChem compound corresponds to the full crystal structure. |
4514024.cif |
| 193399 | 2017-03-04 | cif/ Updating files of 4514024, 4514025, 4514026 Original log message: Adding full bibliography for 4514024--4514026.cif. |
4514024.cif |
| 191946 | 2017-02-10 | cif/ Adding structures of 4514024 via cif-deposit CGI script. |
4514024.cif |
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Users of the data should acknowledge the original authors of the
structural data.