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Information card for entry 4126212
Preview
| Coordinates | 4126212.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | EcoMOF-1 |
|---|---|
| Formula | C76 H127 Ca14 O76 |
| Calculated formula | C76 H127 Ca14 O76 |
| Title of publication | Calcium l-Lactate Frameworks as Naturally Degradable Carriers for Pesticides. |
| Authors of publication | Yang, Jingjing; Trickett, Christopher A.; Alahmadi, Salman B.; Alshammari, Ahmad S.; Yaghi, Omar M. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2017 |
| Journal volume | 139 |
| Journal issue | 24 |
| Pages of publication | 8118 - 8121 |
| a | 24.3868 ± 0.0011 Å |
| b | 13.2612 ± 0.0006 Å |
| c | 24.971 ± 0.001 Å |
| α | 90° |
| β | 90.327 ± 0.002° |
| γ | 90° |
| Cell volume | 8075.4 ± 0.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0755 |
| Residual factor for significantly intense reflections | 0.0621 |
| Weighted residual factors for significantly intense reflections | 0.1685 |
| Weighted residual factors for all reflections included in the refinement | 0.1772 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
| Diffraction radiation wavelength | 0.7749 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 200660 (current) | 2017-09-12 | cif/ Updating files of 4126212 Original log message: Adding full bibliography for 4126212.cif. |
4126212.cif |
| 197777 | 2017-06-14 | cif/ Adding structures of 4126212 via cif-deposit CGI script. |
4126212.cif |
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Users of the data should acknowledge the original authors of the
structural data.