Crystal structure, Hirshfeld surface analysis and HOMO–LUMO analysis of (E)-4-bromo-N′-(4-methoxybenzylidene)benzohydrazide

Crystal structure, Hirshfeld surface analysis and HOMO–LUMO analysis of (E)-4-bromo-N′-(4-methoxybenzylidene)benzohydrazide

The title Schiff base compound, C15H13BrN2O2, displays an E configuration with respect to the C=N double bond, which forms a dihedral angle of 58.06 (9)° with the benzene ring. In the crystal, the molecules are linked into chains parallel to the b axis by N—H...O and C—H...O hydrogen bonds, giving r...

Full description

Bibliographic Details
Main Authors: Kasthuri Balasubramani, Ganesan Premkumar, Palaniyappan Sivajeyanthi, Muthaiah Jeevaraj, Bellarmin Edison, Toka Swu
Format: Article
Language:English
Published: International Union of Crystallography 2018-10-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
crystal structure
Schiff base
intermolecular interactions
Hirshfeld surface analysis
HOMO–LUMO calculation
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2056989018013373

Internet

http://scripts.iucr.org/cgi-bin/paper?S2056989018013373

Similar Items