Title of article
Crystal structure, DFT and MEP study of (E)-2-[(2-hydroxy-5-methoxybenzylidene)amino]benzonitrile
Author/Authors
Haque Faizi, Md. Serajul PG Department of Chemistry - Langat Singh College, India , Dege, Necmi Ondokuz Mayıs Universit- Faculty of Arts and Sciences - Department of Physics, Turkey , Çiçek, Ceren Ondokuz Mayıs University - Faculty of Arts and Sciences -- Department of Chemistr ,Turkey , Agar, Erbil Ondokuz Mayıs University - Faculty of Arts and Sciences -- Department of Chemistr ,Turkey , Fritsky, Igor O. National Taras Shevchenko University - Department of Chemistry, Ukraine
Pages
11
From page
1
To page
11
Abstract
The asymmetric unit of the title compound, C15H12N2O2, contains two crystallographically independent molecules in which the dihedral angles between the benzene rings in each are 13.26 (5) and 7.87 (5)°. An intramolecular O—H⋯N hydrogen bonds results in the formation of an S(6) ring motif. In the crystal, molecules are linked by weak C—H⋯O and C—H⋯N hydrogen bonds, forming layers parallel to (011). In addition, π–π stacking interactions with centroid–centroid distances in the range 3.693 (2)–3.931 (2) Å complete the three-dimensional network.
Keywords
crystal structure , 2-hydroxy-5-methoxybenzaldehyde , weak hydrogen bonding , 2-aminobenzonitrile
Journal title
Acta Crystallographica Section E: Crystallographic Communications
Serial Year
2019
Record number
2627913
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