Information card for entry 1569376
Common name |
L-threonine |
Formula |
C4 H9 N O3 |
Calculated formula |
C4 H9 N O3 |
Title of publication |
High-pressure single-crystal diffraction at the Australian Synchrotron. |
Authors of publication |
Boer, Stephanie A.; Price, Jason R.; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Summers, Aston; Turner, Gemma F.; Jones, Isabelle; Bond, Charles; Vrielink, Alice; Marshall, Andrew C.; Hitchings, John; Moggach, Stephen A. |
Journal of publication |
Journal of synchrotron radiation |
Year of publication |
2023 |
Journal volume |
30 |
Journal issue |
4 |
Pages of publication |
841 - 846 |
a |
5.1489 ± 0.0005 Å |
b |
7.7304 ± 0.0005 Å |
c |
13.602 ± 0.006 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
541.4 ± 0.2 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 K |
Ambient diffracton pressure |
150000 kPa |
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 |
Residual factor for all reflections |
0.0507 |
Residual factor for significantly intense reflections |
0.0404 |
Weighted residual factors for significantly intense reflections |
0.1088 |
Weighted residual factors for all reflections included in the refinement |
0.1423 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.222 |
Diffraction radiation probe |
x-ray |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
Synchrotron |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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The link is:
https://www.crystallography.net/1569376.html