Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 4-[(prop-2-en-1-yloxy)methyl]-3,6-bis(pyridin-2-yl)pyridazine

Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 4-[(prop-2-en-1-yloxy)methyl]-3,6-bis(pyridin-2-yl)pyridazine

The title compound, C18H16N4O, consists of a 3,6-bis(pyridin-2-yl)pyridazine moiety linked to a 4-[(prop-2-en-1-yloxy)methyl] group. The pyridine-2-yl rings are oriented at a dihedral angle of 17.34 (4)° and are rotated slightly out of the plane of the pyridazine ring. In the crystal, C—HPyrd...NPyr...

Full description

Bibliographic Details
Main Authors: Mouad Filali, Nada Kheira Sebbar, Tuncer Hökelek, Joel T. Mague, Said Chakroune, Abdessalam Ben-Tama, El Mestafa El Hadrami
Format: Article
Language:English
Published: International Union of Crystallography 2019-09-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
crystal structure
pyridine
pyridazine
π-stacking
DFT
Hirshfeld surface
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2056989019011186

Internet

http://scripts.iucr.org/cgi-bin/paper?S2056989019011186

Similar Items