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Information card for entry 8105437
Preview
Coordinates | 8105437.cif |
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Original paper (by DOI) | HTML |
Formula | C18 H24 N2 O5 |
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Calculated formula | C18 H24 N2 O5 |
Title of publication | Crystal structure of tert-butyl 2-(hydroxymethyl)-5-{4-[(methoxycarbonyl)amino]phenyl}-2,5-dihydro-1H-pyrrole-1-carboxylate, C18H24N2O5 |
Authors of publication | Caracelli, Ignez; Zukerman-Schpector, Julio; Garcia, Ariel L. Llanes; Costenaro, Edson R.; Correia, Carlos Roque D.; Tiekink, Edward R.T. |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2020 |
Journal volume | 235 |
Journal issue | 5 |
Pages of publication | 1259 - 1261 |
a | 11.4784 ± 0.0007 Å |
b | 9.018 ± 0.0008 Å |
c | 17.9483 ± 0.0017 Å |
α | 90° |
β | 92.823 ± 0.007° |
γ | 90° |
Cell volume | 1855.6 ± 0.3 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/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1658 |
Residual factor for significantly intense reflections | 0.0505 |
Weighted residual factors for significantly intense reflections | 0.1237 |
Weighted residual factors for all reflections included in the refinement | 0.1611 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.977 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/8105437.html
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