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Information card for entry 2231196
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Coordinates | 2231196.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | <i>N</i>-Benzoyl-<i>N</i>-(3-methylphenyl)-<i>O</i>-[2-(2- nitrophenyl)acetyl]hydroxylamine |
---|---|
Formula | C22 H18 N2 O5 |
Calculated formula | C22 H18 N2 O5 |
SMILES | c1(ccccc1CC(=O)ON(C(=O)c1ccccc1)c1cc(ccc1)C)N(=O)=O |
Title of publication | <i>N</i>-Benzoyl-<i>N</i>-(3-methylphenyl)-<i>O</i>-[2-(2-nitrophenyl)acetyl]hydroxylamine |
Authors of publication | Zhang, Kai; He, Dian |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 8 |
Pages of publication | o1966 |
a | 16.34 ± 0.02 Å |
b | 8.459 ± 0.01 Å |
c | 14.862 ± 0.018 Å |
α | 90° |
β | 109.869 ± 0.011° |
γ | 90° |
Cell volume | 1932 ± 4 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 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 | 0.088 |
Residual factor for significantly intense reflections | 0.0501 |
Weighted residual factors for all reflections included in the refinement | 0.1233 |
Goodness-of-fit parameter for all reflections | 1 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
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/2231196.html
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