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Information card for entry 4128747
Preview
| Coordinates | 4128747.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | ZIF-4-hPT-II |
|---|---|
| Chemical name | catena-(tetrakis(μ2-Imidazolato-N,N')-di-zinc(ii) clathrate) |
| Formula | C6 H6 N4 Zn |
| Calculated formula | C6 H6 N4 Zn |
| Title of publication | Rich Polymorphism of a Metal-Organic Framework in Pressure-Temperature Space. |
| Authors of publication | Widmer, Remo N.; Lampronti, Giulio I.; Chibani, Siwar; Wilson, Craig W.; Anzellini, Simone; Farsang, Stefan; Kleppe, Annette K.; Casati, Nicola P. M.; MacLeod, Simon G.; Redfern, Simon A. T.; Coudert, François-Xavier; Bennett, Thomas D. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2019 |
| Journal volume | 141 |
| Journal issue | 23 |
| Pages of publication | 9330 - 9337 |
| a | 13.49627 Å |
| b | 9.884103 Å |
| c | 9.164619 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1222.55 Å3 |
| Cell temperature | 563 K |
| Ambient diffraction temperature | 563 K |
| Ambient diffracton pressure | 810000 kPa |
| Number of distinct elements | 4 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.046 |
| Goodness-of-fit parameter for all reflections | 0.0832 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 0.4246 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 221817 (current) | 2019-11-03 | cif/ Adding structures of 4128747 via cif-deposit CGI script. |
4128747.cif |
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