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Information card for entry 7132159
Preview
| Coordinates | 7132159.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C64 H90 N21 O16 P |
|---|---|
| Calculated formula | C64 H90 N21 O16 P |
| Title of publication | pH-dependent phosphate separation using tripodal hexaurea receptor |
| Authors of publication | Sun, Zhong-Yu; Chen, Si-Qi; Liang, Lin; Zhao, Wei; Yang, Xiao-Juan; Wu, Biao |
| Journal of publication | Chemical Communications |
| Year of publication | 2023 |
| a | 21.9758 ± 0.0014 Å |
| b | 23.498 ± 0.0015 Å |
| c | 14.4237 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 7448.2 ± 0.8 Å3 |
| Cell temperature | 180 K |
| Ambient diffraction temperature | 180 K |
| Number of distinct elements | 5 |
| Space group number | 18 |
| Hermann-Mauguin space group symbol | P 21 21 2 |
| Hall space group symbol | P 2 2ab |
| Residual factor for all reflections | 0.0882 |
| Residual factor for significantly intense reflections | 0.061 |
| Weighted residual factors for significantly intense reflections | 0.1406 |
| Weighted residual factors for all reflections included in the refinement | 0.1539 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286590 (current) | 2023-09-29 | cif/ Adding structures of 7132159 via cif-deposit CGI script. |
7132159.cif |
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Users of the data should acknowledge the original authors of the
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