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Information card for entry 4118509
Preview
| Coordinates | 4118509.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H24 Cl2 Cu N4 O4 |
|---|---|
| Calculated formula | C25 Cl2 Cu N4 O4 |
| Title of publication | Selective Separation of Water, Methanol, and Ethanol by a Porous Coordination Polymer Built with a Flexible Tetrahedral Ligand |
| Authors of publication | Akihito Shigematsu; Teppei Yamada; Hiroshi Kitagawa |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2012 |
| Journal volume | 134 |
| Pages of publication | 13145 - 13147 |
| a | 23.485 ± 0.005 Å |
| b | 23.485 ± 0.005 Å |
| c | 8.995 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4961 ± 3 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 6 |
| Space group number | 94 |
| Hermann-Mauguin space group symbol | P 42 21 2 |
| Hall space group symbol | P 4n 2n |
| Residual factor for significantly intense reflections | 0.0575 |
| Weighted residual factors for all reflections included in the refinement | 0.1672 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4118509.cif |
| 76048 | 2013-03-14 | cif/ Adding structures of 4118509 via cif-deposit CGI script. |
4118509.cif |
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Users of the data should acknowledge the original authors of the
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