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Synthesis, molecular structure and Hirshfeld surface analysis of (4-methoxyphenyl)[2-(methylsulfanyl)thiophen-3-yl]methanone
The title compound, C(13)H(12)O(2)S(2), crystallizes in the triclinic space group P [Image: see text]. The molecular structure is substantially twisted, with a dihedral angle of 43.70 (2)° between the 2-(methylsulfanyl)thiophene and 4-methoxyphenyl rings. In the crystal, molecules are linked...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6281100/ https://www.ncbi.nlm.nih.gov/pubmed/30574377 http://dx.doi.org/10.1107/S2056989018016043 |
Sumario: | The title compound, C(13)H(12)O(2)S(2), crystallizes in the triclinic space group P [Image: see text]. The molecular structure is substantially twisted, with a dihedral angle of 43.70 (2)° between the 2-(methylsulfanyl)thiophene and 4-methoxyphenyl rings. In the crystal, molecules are linked through C—H⋯O interactions and form a bifurcated layer stacking along the b-axis direction and enclosing R (2) (2)(10) ring motifs. The phenyl rings are involved in π–π interactions with a centroid–centroid separation of 3.760 (2) Å. The Hirshfeld surfaces were studied and the contributions of the various intermolecular interactions were quantified. |
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