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Information card for entry 7239013
Preview
Coordinates | 7239013.cif |
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Original paper (by DOI) | HTML |
Formula | C13 H28 N2 O3 |
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Calculated formula | C13 H28 N2 O3 |
Title of publication | Hydrophobic vs. hydrophilic ionic liquid separations strategies in support of continuous pharmaceutical manufacturing |
Authors of publication | Wang, Hui; Gurau, Gabriela; Kelley, Steven P.; Myerson, Allan S.; Rogers, Robin D. |
Journal of publication | RSC Advances |
Year of publication | 2013 |
Journal volume | 3 |
Journal issue | 25 |
Pages of publication | 10019 |
a | 12.2603 ± 0.001 Å |
b | 12.7294 ± 0.0011 Å |
c | 10.9082 ± 0.0009 Å |
α | 90° |
β | 110.413 ± 0.006° |
γ | 90° |
Cell volume | 1595.5 ± 0.2 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1278 |
Residual factor for significantly intense reflections | 0.0675 |
Weighted residual factors for significantly intense reflections | 0.1561 |
Weighted residual factors for all reflections included in the refinement | 0.1907 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
244506 (current) | 2019-11-28 | cif/ Adding structures of 7239013 via cif-deposit CGI script. |
7239013.cif |
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