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Information card for entry 7048656
Preview
| Coordinates | 7048656.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H24 Au Cl N2 |
|---|---|
| Calculated formula | C20 H24 Au Cl N2 |
| Title of publication | Twisting the arm: structural constraints in bicyclic expanded-ring N-heterocyclic carbenes. |
| Authors of publication | Sampford, Katharine R.; Carden, Jamie L.; Kidner, Edward B.; Berry, Abigail; Cavell, Kingsley J.; Murphy, Damien M.; Kariuki, Benson M.; Newman, Paul D. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2019 |
| Journal volume | 48 |
| Journal issue | 5 |
| Pages of publication | 1850 - 1858 |
| a | 8.1533 ± 0.0002 Å |
| b | 17.9539 ± 0.0003 Å |
| c | 13.2803 ± 0.0003 Å |
| α | 90° |
| β | 97.812 ± 0.001° |
| γ | 90° |
| Cell volume | 1925.98 ± 0.07 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0342 |
| Residual factor for significantly intense reflections | 0.0284 |
| Weighted residual factors for significantly intense reflections | 0.0655 |
| Weighted residual factors for all reflections included in the refinement | 0.068 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 223995 (current) | 2019-11-07 | cif/ Updating files of 7048655, 7048656, 7048657, 7048658, 7048659, 7048660, 7048661, 7048662, 7048663, 7048664, 7048665, 7048666, 7048667, 7048668, 7048669 Original log message: Adding full bibliography for 7048655--7048669.cif. |
7048656.cif |
| 213191 | 2019-01-18 | cif/ Adding structures of 7048655, 7048656, 7048657, 7048658, 7048659, 7048660, 7048661, 7048662, 7048663, 7048664, 7048665, 7048666, 7048667, 7048668, 7048669 via cif-deposit CGI script. |
7048656.cif |
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Users of the data should acknowledge the original authors of the
structural data.