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Crystal structure, DFT and MEP study of (E)-2-[(2-hydroxy-5-methoxybenzylidene)amino]benzonitrile

Faizi, Md. Serajul Haque; Dege, Necmi; Cicek, Ceren; Agar, Erbil; Fritsky, Igor O. (Int Union Crystallography, 2019)

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)degrees. An intramolecular ...

Crystal structure and DFT study of (E)-2-chloro-4-{[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl}phenol acetonitrile hemisolvate

Dege, Necmi; Faizi, Md. Serajul Haque; Dogan, Onur Erman; Agar, Erbil; Golenya, Irina A. (Int Union Crystallography, 2019)

The title Schiff base compound, C13H9ClN4O5 center dot 0.5CH(3)CN, crystallizes as an acetonitrile hemisolvate; the solvent molecule being located on a twofold rotation axis. The molecule is nearly planar, with a dihedral ...