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Information card for entry 4126223
Preview
| Coordinates | 4126223.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H12 Ag F3 N2 O2 |
|---|---|
| Calculated formula | C16 H12 Ag F3 N2 O2 |
| Title of publication | Supramolecular Construction of an Aldehyde-Cyclobutane via the Solid State: Combining Reversible Imine Formation and Metal-Organic Self-Assembly. |
| Authors of publication | Oburn, Shalisa M.; Swenson, Dale C.; Mariappan, S. V. Santhana; MacGillivray, Leonard R. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2017 |
| a | 6.9846 ± 0.0013 Å |
| b | 12.927 ± 0.003 Å |
| c | 17.932 ± 0.004 Å |
| α | 90° |
| β | 100.07 ± 0.005° |
| γ | 90° |
| Cell volume | 1594.1 ± 0.6 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 6 |
| 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 | 0.1292 |
| Residual factor for significantly intense reflections | 0.0533 |
| Weighted residual factors for significantly intense reflections | 0.0968 |
| Weighted residual factors for all reflections included in the refinement | 0.1209 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.008 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 197856 (current) | 2017-06-16 | cif/ Adding structures of 4126221, 4126222, 4126223 via cif-deposit CGI script. |
4126223.cif |
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