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Information card for entry 7247927
Preview
| Coordinates | 7247927.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H3 Cl O4 Zn |
|---|---|
| Calculated formula | C8 H3 Cl O4 Zn |
| Title of publication | Torsional flexibility in zinc-benzenedicarboxylate metal-organic frameworks. |
| Authors of publication | Meekel, Emily G.; Nicholas, Thomas C.; Slater, Ben; Goodwin, Andrew L. |
| Journal of publication | CrystEngComm |
| Year of publication | 2024 |
| Journal volume | 26 |
| Journal issue | 5 |
| Pages of publication | 673 - 680 |
| a | 28.4445 ± 0.0005 Å |
| b | 28.4445 ± 0.0005 Å |
| c | 7.8224 ± 0.0001 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 5481.09 ± 0.15 Å3 |
| Cell temperature | 295.15 K |
| Ambient diffraction temperature | 295.15 K |
| Number of distinct elements | 5 |
| Space group number | 166 |
| Hermann-Mauguin space group symbol | R -3 m :H |
| Hall space group symbol | -R 3 2" |
| Residual factor for all reflections | 0.0515 |
| Residual factor for significantly intense reflections | 0.0492 |
| Weighted residual factors for significantly intense reflections | 0.1553 |
| Weighted residual factors for all reflections included in the refinement | 0.1576 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.124 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 289439 (current) | 2024-02-04 | cif/ Updating files of 7247925, 7247926, 7247927, 7247928, 7247929, 7247930 Original log message: Adding full bibliography for 7247925--7247930.cif. |
7247927.cif |
| 288581 | 2024-01-01 | cif/ Adding structures of 7247925, 7247926, 7247927, 7247928, 7247929, 7247930 via cif-deposit CGI script. |
7247927.cif |
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Users of the data should acknowledge the original authors of the
structural data.