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Information card for entry 2011840
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| Coordinates | 2011840.cif |
|---|---|
| Structure factors | 2011840.hkl |
| Original IUCr paper | HTML |
| Common name | tricine |
|---|---|
| Chemical name | N-[tris(hydroxymethyl)methyl]glycine or N-(2-hydroxy-1,1-bis[hydroxymethyl]ethyl)glycine |
| Formula | C6 H13 N O5 |
| Calculated formula | C6 H13 N O5 |
| SMILES | O=C([O-])C[NH2+]C(CO)(CO)CO |
| Title of publication | <i>N</i>-[Tris(hydroxymethyl)methyl]glycine (tricine) |
| Authors of publication | Ramos Silva, M.; Paixão, J. A.; Matos Beja, A.; Alte da Veiga, L. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 4 |
| Pages of publication | 421 - 422 |
| a | 6.2806 ± 0.0016 Å |
| b | 13.5616 ± 0.0013 Å |
| c | 9.6165 ± 0.001 Å |
| α | 90° |
| β | 107.488 ± 0.011° |
| γ | 90° |
| Cell volume | 781.2 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.039 |
| Residual factor for significantly intense reflections | 0.03 |
| Weighted residual factors for all reflections included in the refinement | 0.089 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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