Geometry & MOs

Info

ID:	407266
PubChem CID:	135079698
Reduced:	BrN2H15C16 (1)
Stoich.:	AB2C15D16 (1)
Weight, g/mol:	344.05243
ΔH_f, kcal/mol:	88.43
Dipole, Da:	2.74
IP(EA), eV:	-8.31(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-[(E)-4-(3-bromo-4-methoxyphenyl)but-3-en-2-ylidene]amino]aniline

Drug info:

PubChemData

Smile

C/C(=N\NC1=CC=CC=C1)/C=C/C2=CC(=CC=C2)Br

DOS

IR

Vibrations