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Information card for entry 1000019
Preview
| Coordinates | 1000019.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6 H16 N2 O3 |
|---|---|
| Calculated formula | C6 H16 N2 O3 |
| Title of publication | Understanding the Solid-State Hydration Behavior of a Common Amino Acid: Identification, Structural Characterization, and Hydration/Dehydration Processes of New Hydrate Phases of l-Lysine |
| Authors of publication | Williams, P. Andrew; Hughes, Colan E.; Martin, Jean; Courvoisier, Emilie; Buanz, Asma B. M.; Gaisford, Simon; Harris, Kenneth D. M. |
| Journal of publication | The Journal of Physical Chemistry C |
| Year of publication | 2016 |
| Journal volume | 120 |
| Journal issue | 17 |
| Pages of publication | 9385 - 9392 |
| a | 5.93493 ± 0.0001 Å |
| b | 6.94133 ± 0.00011 Å |
| c | 20.5754 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 847.63 ± 0.03 Å3 |
| Ambient diffraction temperature | 294 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| RFsqd | 0.09509 |
| Goodness-of-fit parameter for all reflections | 1.47 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.5406 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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Users of the data should acknowledge the original authors of the
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