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Information card for entry 7229415
Preview
Coordinates | 7229415.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H19 N O |
---|---|
Calculated formula | C19 H19 N O |
SMILES | c12ccc(cc1C(CO2)(C)CC#Cc1cccc(N)c1)C |
Title of publication | Microwave assisted domino heck cyclization and alkynylation: synthesis of alkyne substituted dihydrobenzofurans |
Authors of publication | Karu, Ramesh; Gedu, Satyanarayana |
Journal of publication | Green Chemistry |
Year of publication | 2018 |
Journal volume | 20 |
Journal issue | 2 |
Pages of publication | 369 |
a | 14.0947 ± 0.0004 Å |
b | 5.86763 ± 0.00014 Å |
c | 18.4634 ± 0.0005 Å |
α | 90° |
β | 97.511 ± 0.003° |
γ | 90° |
Cell volume | 1513.87 ± 0.07 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 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 | 0.0832 |
Residual factor for significantly intense reflections | 0.0581 |
Weighted residual factors for significantly intense reflections | 0.1844 |
Weighted residual factors for all reflections included in the refinement | 0.2002 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.2425 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7229415.html
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Users of the data should acknowledge the original authors of the
structural data.