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Information card for entry 7218262
Preview
Coordinates | 7218262.cif |
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Original paper (by DOI) | HTML |
Formula | C25 H25 N O4 S |
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Calculated formula | C25 H25 N O4 S |
SMILES | S1C2=C(C(c3ccc(OC)cc3)C3=C(N2CC1)CC(C)(CC3=O)C)C(=O)c1occc1 |
Title of publication | Catalyst-free one-pot four-component domino reactions in water‒PEG-400: highly efficient and convergent approach to thiazoloquinoline scaffolds |
Authors of publication | Nagaraju, Anugula; Ramulu, B. Janaki; Shukla, Gaurav; Srivastava, Abhijeet; Verma, Girijesh Kumar; Raghuvanshi, Keshav; Singh, Maya Shankar |
Journal of publication | Green Chem. |
Year of publication | 2015 |
Journal volume | 17 |
Journal issue | 2 |
Pages of publication | 950 |
a | 12.2796 ± 0.0006 Å |
b | 11.7459 ± 0.0004 Å |
c | 15.808 ± 0.0009 Å |
α | 90° |
β | 102.781 ± 0.005° |
γ | 90° |
Cell volume | 2223.57 ± 0.19 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
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 | 0.1229 |
Residual factor for significantly intense reflections | 0.0597 |
Weighted residual factors for significantly intense reflections | 0.1079 |
Weighted residual factors for all reflections included in the refinement | 0.1339 |
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 |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7218262.html
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Users of the data should acknowledge the original authors of the
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