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Crystal structure of N-(2-benzoyl-5-ethynylphenyl)quinoline-2-carboxamide
In the title compound, C(25)H(16)N(2)O(2), the quinoline ring system is essentially planar, with a maximum deviation of 0.030 (1) Å, and forms a dihedral angle of 20.9 (1)° with benzoyl benzene ring. The unsubstituted phenyl ring forms dihedral angles of 52.7 (1)° with the quinoline ring system and...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5382631/ https://www.ncbi.nlm.nih.gov/pubmed/28435730 http://dx.doi.org/10.1107/S2056989017004601 |
Sumario: | In the title compound, C(25)H(16)N(2)O(2), the quinoline ring system is essentially planar, with a maximum deviation of 0.030 (1) Å, and forms a dihedral angle of 20.9 (1)° with benzoyl benzene ring. The unsubstituted phenyl ring forms dihedral angles of 52.7 (1)° with the quinoline ring system and 54.1 (1)° with the ethynyl-substituted benzene ring. The molecule contains an intramolecular bifurcated N—H⋯(O,N) hydrogen bond, forming S(5) and S(6) rings, which may influence the conformation of the molecule. In the crystal, weak C—H⋯O hydrogen bonds link the molecules into a three-dimensional network. In addition, the three-dimensional structure contains π–π stacking interactions, with centroid–centroid distances of 3.695 (1) and 3.751 (1) Å. |
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