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Information card for entry 8101871
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Coordinates | 8101871.cif |
---|---|
External links | ChemSpider |
Chemical name | 2'-(3-benzoxy-4-fluorobenzylidene)-2-hydroxybenzoylhydrazide |
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Formula | C20 H15 F N2 O3 |
Calculated formula | C20 H15 F N2 O3 |
SMILES | O=C(NN=Cc1cc(Oc2ccccc2)c(F)cc1)c1ccccc1O |
Title of publication | Crystal structure of 2'-(3-benzoxy-4-fluorobenzylidene)-2- hydroxybenzoylhydrazide, C~20~H~15~FN~2~O~3~ |
Authors of publication | Liang, H.-D.; Yang, J.-G.; Yan, H.; Pan, F.-Y. |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2005 |
Journal volume | 220 |
Journal issue | 4 |
Pages of publication | 585 - 586 |
a | 25.765 ± 0.004 Å |
b | 11.185 ± 0.0016 Å |
c | 5.9115 ± 0.0008 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1703.6 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.1095 |
Residual factor for significantly intense reflections | 0.0518 |
Weighted residual factors for significantly intense reflections | 0.1113 |
Weighted residual factors for all reflections included in the refinement | 0.1254 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.759 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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