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Information card for entry 2221273
Preview
Coordinates | 2221273.cif |
---|---|
Structure factors | 2221273.hkl |
Original IUCr paper | HTML |
Chemical name | Methyl 2-[2-((<i>Z</i>)-{1-<i>trans</i>-[2-(4-fluoro-3-methylphenyl)-2-\ methylcyclopropyl]ethylidene}aminooxymethyl)phenyl]-2-[(<i>E</i>)-\ methoxyimino]acetate |
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Formula | C24 H27 F N2 O4 |
Calculated formula | C24 H27 F N2 O4 |
SMILES | Fc1ccc(cc1C)[C@]1(C)C[C@H]1C(=N\OCc1ccccc1/C(=N\OC)C(=O)OC)/C.Fc1ccc(cc1C)[C@@]1(C)C[C@@H]1C(=N\OCc1ccccc1/C(=N\OC)C(=O)OC)/C |
Title of publication | Methyl 2-[2-((<i>Z</i>)-{1-<i>trans</i>-[2-(4-fluoro-3-methylphenyl)-2-methylcyclopropyl]ethylidene}aminooxymethyl)phenyl]-2-[(<i>E</i>)-methoxyimino]acetate |
Authors of publication | Song, Chunfeng; Ross, Ronald; Shaber, Steven; Li, Bin |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2009 |
Journal volume | 65 |
Journal issue | 4 |
Pages of publication | o796 |
a | 7.819 ± 0.003 Å |
b | 10.901 ± 0.004 Å |
c | 14.565 ± 0.005 Å |
α | 105.134 ± 0.004° |
β | 92.014 ± 0.004° |
γ | 104.718 ± 0.004° |
Cell volume | 1152.2 ± 0.7 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0627 |
Residual factor for significantly intense reflections | 0.0458 |
Weighted residual factors for significantly intense reflections | 0.1288 |
Weighted residual factors for all reflections included in the refinement | 0.14 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2221273.html
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