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Information card for entry 1551319
Preview
| Coordinates | 1551319.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H62 N8 O16 |
|---|---|
| Calculated formula | C30 H36 N8 O16 |
| Title of publication | Trapping virtual pores by crystal retro-engineering |
| Authors of publication | Marc A. Little; Michael E. Briggs; James T. A. Jones; Marc Schmidtmann; Tom Hasell; Samantha Y. Chong; Kim E. Jelfs; Linjiang Chen; Andrew I. Cooper |
| Journal of publication | Nature Chemistry |
| Year of publication | 2015 |
| Journal volume | 7 |
| Pages of publication | 153 - 159 |
| a | 20.1798 ± 0.0008 Å |
| b | 20.1798 ± 0.0008 Å |
| c | 20.1798 ± 0.0008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 8217.7 ± 0.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 4 |
| Space group number | 213 |
| Hermann-Mauguin space group symbol | P 41 3 2 |
| Hall space group symbol | P 4bd 2ab 3 |
| Residual factor for all reflections | 0.0627 |
| Residual factor for significantly intense reflections | 0.057 |
| Weighted residual factors for significantly intense reflections | 0.1809 |
| Weighted residual factors for all reflections included in the refinement | 0.1854 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.48 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 215816 (current) | 2019-06-11 | cif/ Adding structures of 1551319 via cif-deposit CGI script. |
1551319.cif |
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Users of the data should acknowledge the original authors of the
structural data.