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Information card for entry 7712607
Preview
| Coordinates | 7712607.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | UTD100 |
|---|---|
| Formula | C21 H19 Cu N3 O5 |
| Calculated formula | C21 H19 Cu N3 O5 |
| Title of publication | Transformation of a copper-based metal-organic polyhedron into a mixed linker MOF for CO<sub>2</sub> capture. |
| Authors of publication | Abbas, Muhammad; Maceda, Amanda M.; Xiao, Zhifeng; Zhou, Hong-Cai; Balkus, Jr, Kenneth J |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2023 |
| a | 9.8053 ± 0.0002 Å |
| b | 15.594 ± 0.0003 Å |
| c | 13.0691 ± 0.0003 Å |
| α | 90° |
| β | 95.514 ± 0.001° |
| γ | 90° |
| Cell volume | 1989.07 ± 0.07 Å3 |
| Cell temperature | 112 K |
| Ambient diffraction temperature | 112 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 | 0.0414 |
| Residual factor for significantly intense reflections | 0.0291 |
| Weighted residual factors for significantly intense reflections | 0.0735 |
| Weighted residual factors for all reflections included in the refinement | 0.0795 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281876 (current) | 2023-03-15 | cif/ Adding structures of 7712607 via cif-deposit CGI script. |
7712607.cif |
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