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Information card for entry 2312157
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Coordinates | 2312157.cif |
---|---|
Structure factors | 2312157.hkl |
Original IUCr paper | HTML |
Chemical name | (<i>E</i>)-2-{[(4-Methoxynaphthalen-1-yl)methylidene]amino}-4-methylphenol |
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Formula | C19 H17 N O2 |
Calculated formula | C19 H17 N O2 |
Title of publication | The synthesis and crystal structure of (E)-2-{[(4-methoxynaphthalen-1-yl)methylidene]amino}-4-methylphenol: Hirshfeld surface analysis, DFT calculations and anticorrosion studies. |
Authors of publication | Yahiaoui, Ahmed Abderrahim; Ghichi, Nadir; Hannachi, Douniazed; Mezhoud, Bilel; Djedouani, Amel; Kraim, Khairedine; Crochet, Aurélien; Stoeckli-Evans, Helen |
Journal of publication | Acta crystallographica. Section C, Structural chemistry |
Year of publication | 2023 |
Journal volume | 79 |
Journal issue | 8 |
a | 7.774 ± 0.0004 Å |
b | 7.9955 ± 0.0004 Å |
c | 12.4836 ± 0.0006 Å |
α | 106.383 ± 0.004° |
β | 98.191 ± 0.004° |
γ | 93.279 ± 0.004° |
Cell volume | 732.96 ± 0.07 Å3 |
Cell temperature | 250 ± 2 K |
Ambient diffraction temperature | 250 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0422 |
Residual factor for significantly intense reflections | 0.038 |
Weighted residual factors for significantly intense reflections | 0.108 |
Weighted residual factors for all reflections included in the refinement | 0.1125 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
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The link is: https://www.crystallography.net/2312157.html
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