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Information card for entry 1546100
Preview
| Coordinates | 1546100.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 3 |
|---|---|
| Chemical name | Zn(A-ip)(bipy) |
| Formula | C21 H16 N2 O5 Zn |
| Calculated formula | C21 H16 N2 O5 Zn |
| Title of publication | Linker functionalisation triggers an alternative 3D-topology for Zn-isophthalate-4,4′-bipyridine frameworks |
| Authors of publication | Schneemann, Andreas; Rudolf, Robin; Henke, Sebastian; Takahashi, Yukiko; Banh, Hung; Hante, Inke; Schneider, Christian; Noro, Shin-ichiro; Fischer, Roland A. |
| Journal of publication | Dalton Transactions |
| Year of publication | 2017 |
| Journal volume | 46 |
| Journal issue | 25 |
| Pages of publication | 8198 - 8203 |
| a | 11.3928 ± 0.0003 Å |
| b | 15.6359 ± 0.0005 Å |
| c | 16.3018 ± 0.0006 Å |
| α | 90° |
| β | 96.451 ± 0.003° |
| γ | 90° |
| Cell volume | 2885.56 ± 0.16 Å3 |
| Cell temperature | 102.9 ± 0.3 K |
| Ambient diffraction temperature | 102.9 ± 0.3 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0583 |
| Residual factor for significantly intense reflections | 0.0545 |
| Weighted residual factors for significantly intense reflections | 0.1597 |
| Weighted residual factors for all reflections included in the refinement | 0.164 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.102 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 282777 (current) | 2023-04-20 | cod/ (saulius@starta) Updating COD bibliographies for 271 COD entries identified by R.M. |
1546100.cif |
| 196925 | 2017-05-24 | cif/ Adding structures of 1546100, 1546101, 1546102, 1546103 via cif-deposit CGI script. |
1546100.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
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.
Users of the data should acknowledge the original authors of the
structural data.