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Information card for entry 4037473
Preview
Coordinates | 4037473.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H35 N O4 |
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Calculated formula | C26 H35 N O4 |
SMILES | O(c1c(C(c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)CC#N)cc(OC)c(OC)c1)C |
Title of publication | Synthesis of Amides and Nitriles from Vinyl Azides and p-Quinone Methides. |
Authors of publication | Lin, Chen; Shen, Yangyong; Huang, Bo; Liu, Yu; Cui, Sunliang |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2017 |
Journal volume | 82 |
Journal issue | 7 |
Pages of publication | 3950 - 3956 |
a | 14.837 ± 0.002 Å |
b | 10.7069 ± 0.0016 Å |
c | 16.375 ± 0.003 Å |
α | 90° |
β | 110.019 ± 0.003° |
γ | 90° |
Cell volume | 2444.1 ± 0.7 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296.15 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 | 0.0955 |
Residual factor for significantly intense reflections | 0.0465 |
Weighted residual factors for significantly intense reflections | 0.1123 |
Weighted residual factors for all reflections included in the refinement | 0.138 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
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/4037473.html
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