Geometry & MOs

Info

ID:	432868
PubChem CID:	135173005
Reduced:	FOSN8H19C24 (1)
Stoich.:	ABCD8E19F24 (1)
Weight, g/mol:	334.154209
ΔH_f, kcal/mol:	131.93
Dipole, Da:	5.53
IP(EA), eV:	-8.8(-2.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[4-[(1-methylimidazol-2-yl)diazenyl]anilino]phenyl]acetamide

Drug info:

PubChemData

Smile

CCC(NC1=CN=CC(=C1)C2=NC=C3C(=C2F)/C(=C\4/N=C5C=NC=C(C5=N4)C6=CC=CS6)/NN3)O

DOS

IR

Vibrations