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Information card for entry 2238947
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Coordinates | 2238947.cif |
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Original IUCr paper | HTML |
Chemical name | <i>N</i>'-[(<i>E</i>)-2-Fluorobenzylidene]benzohydrazide |
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Formula | C14 H11 F N2 O |
Calculated formula | C14 H11 F N2 O |
SMILES | O=C(c1ccccc1)N/N=C/c1ccccc1F |
Title of publication | <i>N</i>'-[(<i>E</i>)-2-Fluorobenzylidene]benzohydrazide |
Authors of publication | Sreeja, P. B.; Sithambaresan, M.; Aiswarya, N.; Kurup, M. R. Prathapachandra |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2013 |
Journal volume | 69 |
Journal issue | 12 |
Pages of publication | o1828 |
a | 9.701 ± 0.0006 Å |
b | 17.4114 ± 0.0013 Å |
c | 15.002 ± 0.001 Å |
α | 90° |
β | 104.126 ± 0.004° |
γ | 90° |
Cell volume | 2457.3 ± 0.3 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1016 |
Residual factor for significantly intense reflections | 0.0503 |
Weighted residual factors for significantly intense reflections | 0.1315 |
Weighted residual factors for all reflections included in the refinement | 0.1649 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
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/2238947.html
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