Geometry & MOs

Info

ID:	21749
PubChem CID:	589752
Reduced:	BrON3C16H16 (1)
Stoich.:	ABC3D16E16 (1)
Weight, g/mol:	345.04767
ΔH_f, kcal/mol:	46.0
Dipole, Da:	6.06
IP(EA), eV:	-8.2(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[[4-(dimethylamino)phenyl]methylideneamino]benzamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C=NNC(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations