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Information card for entry 4002684
Preview
| Coordinates | 4002684.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | (py3tren)AlCoMe |
|---|---|
| Chemical name | (py3tren)AlCoMe |
| Formula | C28 H33 Al Co N7 |
| Calculated formula | C28 H33 Al Co N7 |
| Title of publication | Installing Heterobimetallic Cobalt‒Aluminum Single Sites on a Metal Organic Framework Support |
| Authors of publication | Thompson, Anthony B.; Pahls, Dale R.; Bernales, Varinia; Gallington, Leighanne C.; Malonzo, Camille D.; Webber, Thomas; Tereniak, Stephen J.; Wang, Timothy C.; Desai, Sai Puneet; Li, Zhanyong; Kim, In Soo; Gagliardi, Laura; Penn, R. Lee; Chapman, Karena W.; Stein, Andreas; Farha, Omar K.; Hupp, Joseph T.; Martinson, Alex B. F.; Lu, Connie C. |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2016 |
| Journal volume | 28 |
| Journal issue | 18 |
| Pages of publication | 6753 |
| a | 9.3796 ± 0.0015 Å |
| b | 10.578 ± 0.0017 Å |
| c | 14.373 ± 0.002 Å |
| α | 78.924 ± 0.002° |
| β | 72.613 ± 0.002° |
| γ | 81.559 ± 0.002° |
| Cell volume | 1329.4 ± 0.4 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0595 |
| Residual factor for significantly intense reflections | 0.0401 |
| Weighted residual factors for significantly intense reflections | 0.0892 |
| Weighted residual factors for all reflections included in the refinement | 0.099 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 186905 (current) | 2016-10-04 | cif/ Adding structures of 4002682, 4002683, 4002684, 4002685 via cif-deposit CGI script. |
4002684.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.