4-[(1-Benzyl-1H-1,2,3-triazol-4-yl)methoxy]benzene-1,2-dicarbonitrile: crystal structure, Hirshfeld surface analysis and energy-minimization calculations

• Main Authors: Norzianah Shamsudin, Tan, Ai Ling, Young, David J., Jotani, Mukesh M., Otero-de-la-Roza, Alberto, Tiekink, Edward R. T. *
• Format: Article
• Language: English
• Published: International Union of Crystallography 2016
• Subjects: QD Chemistry
• Online Access: http://eprints.sunway.edu.my/642/1/Acta%20E_RC%202016%2072%20563.pdf; http://eprints.sunway.edu.my/642/; http://dx.doi.org/10.1107/S2056989016004722
• Institution: Sunway University

In the solid state, the title compound, C18H13N5O, adopts a conformation whereby the phenyl ring and meth­oxy-benzene-1,2-dicarbo­nitrile residue (r.m.s. deviation of the 12 non-H atoms = 0.041 Å) lie to opposite sides of the central triazolyl ring, forming dihedral angles of 79.30 (13) and 64.59 (1...