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N-(Quinolin-8-yl)quinoline-2-carbox-amide.
Yanfeng Li1, Hongbo Zhou, Xiaoping Shen
1School of Chemistry and Chemical Engineering, Jiangsu University, Zhenjiang 212013, People's Republic of China.
This study details the crystal structure of a novel organic compound, C(19)H(13)N(3)O. Molecular conformation is stabilized by intramolecular hydrogen bonds and weak π-π interactions between quinoline rings.
Area of Science:
- Crystallography
- Organic Chemistry
- Supramolecular Chemistry
Background:
- Understanding molecular conformation and intermolecular interactions is crucial in crystal engineering.
- Quinoline derivatives are important scaffolds in medicinal chemistry and materials science.
Purpose of the Study:
- To elucidate the crystal structure and intermolecular interactions of the title compound, C(19)H(13)N(3)O.
- To analyze the molecular conformation and hydrogen bonding network within the crystal lattice.
Main Methods:
- Single-crystal X-ray diffraction was employed to determine the three-dimensional structure.
- Analysis of hydrogen bonding and π-π interactions was performed using crystallographic data.
Main Results:
- The dihedral angle between the two quinoline systems was determined to be 11.54(3)°.
- Intramolecular N-H⋯N (bifurcated) and C-H⋯O hydrogen bonds stabilize the molecular conformation.
- Weak intermolecular π-π interactions between quinoline rings were observed with a centroid-centroid distance of 3.7351(14) Å.
Conclusions:
- The crystal structure reveals a specific molecular conformation influenced by intramolecular hydrogen bonding.
- Intermolecular π-π interactions contribute to the overall crystal packing.
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