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Information card for entry 7222233
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Coordinates | 7222233.cif |
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Original paper (by DOI) | HTML |
Formula | C16 H17 N O3 |
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Calculated formula | C17.5 H19.5 N O3 |
Title of publication | Synthesis and evaluation of novel quinuclidinone derivatives as potential anti-proliferative agents |
Authors of publication | Soni, Jigar Y.; Sanghvi, Shridhar; Devkar, Ranjitsinh V.; Thakore, Sonal |
Journal of publication | RSC Adv. |
Year of publication | 2015 |
a | 5.8724 ± 0.0003 Å |
b | 8.1184 ± 0.0003 Å |
c | 17.0501 ± 0.001 Å |
α | 90° |
β | 94.221 ± 0.005° |
γ | 90° |
Cell volume | 810.65 ± 0.07 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0878 |
Residual factor for significantly intense reflections | 0.085 |
Weighted residual factors for significantly intense reflections | 0.243 |
Weighted residual factors for all reflections included in the refinement | 0.2507 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.31 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
158179 (current) | 2015-09-19 | cif/ Adding structures of 7222232, 7222233 via cif-deposit CGI script. |
7222233.cif |
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Users of the data should acknowledge the original authors of the
structural data.