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Information card for entry 1577388
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| Coordinates | 1577388.cif |
|---|---|
| Structure factors | 1577388.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | catena-[bis(m-2-(4,6-diamino-1,3,5-triazin-2-yl)pyridine-4-carboxylato)-manganese N,N-dimethylformamide solvate] |
|---|---|
| Formula | C27 H35 Mn N15 O7 |
| Calculated formula | C27 H35 Mn N15 O7 |
| Title of publication | Functional organic ligands tailored by carboxylic acid and diaminotriazinyl for metal-organic framework preparations |
| Authors of publication | Duy Tuan Doan; Thi Linh Giang Hoang; Thi Thom Nguyen; Thierry Maris; Phuong Nguyen-Triv |
| Journal of publication | J Mol. Struct |
| Year of publication | 2026 |
| Journal volume | 1352 |
| Pages of publication | 144349 |
| a | 17.6006 ± 0.0007 Å |
| b | 18.2073 ± 0.0008 Å |
| c | 21.6851 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 6949.2 ± 0.5 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.1304 |
| Residual factor for significantly intense reflections | 0.0666 |
| Weighted residual factors for significantly intense reflections | 0.1657 |
| Weighted residual factors for all reflections included in the refinement | 0.2021 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 306530 (current) | 2026-06-09 | cif/ hkl/ Adding structures of 1577388 via cif-deposit CGI script. |
1577388.cif 1577388.hkl |
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Users of the data should acknowledge the original authors of the
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