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Information card for entry 7214120
Preview
Coordinates | 7214120.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H17 N O5 |
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Calculated formula | C26 H17 N O5 |
SMILES | O=N(=O)c1ccc([C@H]2[C@H]3[C@@](O)(Oc4ccc5ccccc5c24)c2c(C3=O)cccc2)cc1.O=N(=O)c1ccc([C@@H]2[C@@H]3[C@](O)(Oc4ccc5ccccc5c24)c2c(C3=O)cccc2)cc1 |
Title of publication | Heterogeneous ditopic ZnFe2O4 catalyzed synthesis of 4H-pyrans: further conversion to 1,4-DHPs and report of functional group interconversion from amide to ester |
Authors of publication | Das, Paramita; Dutta, Arghya; Bhaumik, Asim; Mukhopadhyay, Chhanda |
Journal of publication | Green Chemistry |
Year of publication | 2014 |
Journal volume | 16 |
Journal issue | 3 |
Pages of publication | 1426 |
a | 6.937 ± 0.005 Å |
b | 11.638 ± 0.009 Å |
c | 13.019 ± 0.01 Å |
α | 75.535 ± 0.008° |
β | 89.874 ± 0.009° |
γ | 76.165 ± 0.008° |
Cell volume | 986.4 ± 1.3 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0998 |
Residual factor for significantly intense reflections | 0.0635 |
Weighted residual factors for significantly intense reflections | 0.1788 |
Weighted residual factors for all reflections included in the refinement | 0.2145 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.931 |
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/7214120.html
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