Journal
ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS
Volume 75, Issue -, Pages 912-+Publisher
INT UNION CRYSTALLOGRAPHY
DOI: 10.1107/S2056989019007473
Keywords
crystal structure; quinoline; offset pi-pi interactions; Hirshfeld surface analysis; DFT
Categories
Funding
- Deanship of Scientific Research at Prince Sattam Bin Abdulaziz University [2017/01/7199]
Ask authors/readers for more resources
In the title quinoline derivative, C14H14ClNO3, there is an intramolecular C-H center dot center dot center dot O hydrogen bond forming an S(6) graph-set motif. The molecule is essentially planar with the mean plane of the ethyl acetate group making a dihedral angle of 5.02 (3)degrees with the ethyl 6-chloro-2-ethoxyquinoline mean plane. In the crystal, offset pi-pi interactions with a centroid-to-centroid distance of 3.4731 (14) angstrom link inversion-related molecules into columns along the c-axis direction. Hirshfeld surface analysis indicates that H center dot center dot center dot H contacts make the largest contribution (50.8%) to the Hirshfeld surface.
Authors
I am an author on this paper
Click your name to claim this paper and add it to your profile.
Reviews
Recommended
No Data Available