Vibrational spectroscopy investigation using ab initio and DFT vibrational analysis of 7-chloro-2-methylamino-5-phenyl-3H-1,4-benzodiazepine-4-oxide

Molecular structure of 7-chloro-2-methylamino-5-phenyl-3H-1, 4-benzodiazepine-4-oxide. The theoretical calculations shows, 7CMP4BO has a structure of C1 point group has 35 atoms and 99 modes of fundamental vibrations.