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Information card for entry 1545569
Preview
| Coordinates | 1545569.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C3 H14 Al2 F3 N2 O6 P |
|---|---|
| Calculated formula | C3 Al2 F3 N2 O6 P |
| Title of publication | Synthesis and ab Initio Structure Determination from X-Ray Powder Diffraction of MIL-12, a New Layered Fluoroaluminophosphate Templated with 1,3 Diaminopropane: [N2C3H12]Al2(PO4)(OHx, F5-x) (x close to 2) |
| Authors of publication | Simon, N.; Guillou, N.; Loiseau, T.; Taulelle, F.; Ferey, G. |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 1999 |
| Journal volume | 147 |
| Pages of publication | 92 - 98 |
| a | 11.072 ± 0.001 Å |
| b | 7.012 ± 0.001 Å |
| c | 6.1096 ± 0.0008 Å |
| α | 90° |
| β | 100.98 ± 0.01° |
| γ | 90° |
| Cell volume | 465.65 ± 0.1 Å3 |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 7 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| RFsqd | 0.062 |
| Residual factor R(I) for significantly intense reflections | 0.088 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 194263 (current) | 2017-03-15 | cif/ Adding structures of 1545569 via cif-deposit CGI script. |
1545569.cif |
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Users of the data should acknowledge the original authors of the
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