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Information card for entry 7061977
Preview
Coordinates | 7061977.cif |
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Original paper (by DOI) | HTML |
Formula | C14 H18 N2 O2 |
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Calculated formula | C14 H18 N2 O2 |
Title of publication | Electrochemically promoted annulation of aldehydes and carbazates: access to 2-alkoxy/aryloxy-5-substituted 1,3,4-oxadiazole and 1,3,4-oxadiazol-2(3H)-one derivatives |
Authors of publication | Li, Hongjun; Tang, Dong; Iqbal, Zafar; Wan, Yaya; Jiang, Rui; Yang, Zhixiang; Yang, Jinhui |
Journal of publication | New Journal of Chemistry |
Year of publication | 2022 |
Journal volume | 46 |
Journal issue | 42 |
Pages of publication | 20347 - 20353 |
a | 7.1933 ± 0.0004 Å |
b | 17.2296 ± 0.0012 Å |
c | 11.4006 ± 0.0006 Å |
α | 90° |
β | 106.909 ± 0.006° |
γ | 90° |
Cell volume | 1351.88 ± 0.15 Å3 |
Cell temperature | 150 ± 0.1 K |
Ambient diffraction temperature | 150 ± 0.1 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0696 |
Residual factor for significantly intense reflections | 0.0622 |
Weighted residual factors for significantly intense reflections | 0.1664 |
Weighted residual factors for all reflections included in the refinement | 0.1738 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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