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Information card for entry 4131164
Preview
| Coordinates | 4131164.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C95 H29 N2 O2 |
|---|---|
| Calculated formula | C95 H29 N2 O2 |
| Title of publication | Silver(I)-Mediated Modification, Dimerization, and Polymerization of an Open-Cage Fullerene. |
| Authors of publication | Aghabali, Amineh; Jun, Sharon; Olmstead, Marilyn M.; Balch, Alan L. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2016 |
| Journal volume | 138 |
| Journal issue | 50 |
| Pages of publication | 16459 - 16465 |
| a | 10.0211 ± 0.0005 Å |
| b | 16.2229 ± 0.0009 Å |
| c | 16.7816 ± 0.0008 Å |
| α | 82.685 ± 0.003° |
| β | 85.938 ± 0.003° |
| γ | 76.786 ± 0.003° |
| Cell volume | 2631.9 ± 0.2 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0893 |
| Residual factor for significantly intense reflections | 0.0624 |
| Weighted residual factors for significantly intense reflections | 0.1601 |
| Weighted residual factors for all reflections included in the refinement | 0.1781 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 241444 (current) | 2019-11-25 | cif/ Adding structures of 4131164 via cif-deposit CGI script. |
4131164.cif |
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Users of the data should acknowledge the original authors of the
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