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Information card for entry 2108374
Preview
Coordinates | 2108374.cif |
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Structure factors | 2108374.hkl |
Original paper (by DOI) | HTML |
Chemical name | <i>L</i>-Leucinium hydrogen maleate |
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Formula | C10 H17 N O6 |
Calculated formula | C10 H17 N O6 |
SMILES | O=C(O)/C=C\C(=O)[O-].O=C(O)[C@@H]([NH3+])CC(C)C |
Title of publication | A large anisotropic plasticity of <small>L</small>-leucinium hydrogen maleate preserved at cryogenic temperatures |
Authors of publication | Arkhipov, S. G.; Losev, E. A.; Nguyen, T. T.; Rychkov, D. A.; Boldyreva, E. V. |
Journal of publication | Acta Crystallographica Section B |
Year of publication | 2019 |
Journal volume | 75 |
Journal issue | 2 |
a | 21.4563 ± 0.0009 Å |
b | 5.67251 ± 0.00019 Å |
c | 32.0779 ± 0.0008 Å |
α | 90° |
β | 99.653 ± 0.003° |
γ | 90° |
Cell volume | 3849 ± 0.2 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 K |
Number of distinct elements | 4 |
Space group number | 5 |
Hermann-Mauguin space group symbol | C 1 2 1 |
Hall space group symbol | C 2y |
Residual factor for all reflections | 0.0927 |
Residual factor for significantly intense reflections | 0.05 |
Weighted residual factors for significantly intense reflections | 0.1077 |
Weighted residual factors for all reflections included in the refinement | 0.1355 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
214120 (current) | 2019-03-14 | cif/ hkl/ Adding structures of 2108370, 2108371, 2108372, 2108373, 2108374, 2108375, 2108376, 2108377, 2108378 via cif-deposit CGI script. |
2108374.cif 2108374.hkl |
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Users of the data should acknowledge the original authors of the
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