Geometry & MOs

Info

ID:	406530
PubChem CID:	135077963
Reduced:	ClFO2N4H14C16 (1)
Stoich.:	ABC2D4E14F16 (1)
Weight, g/mol:	372.135304
ΔH_f, kcal/mol:	-1.87
Dipole, Da:	5.38
IP(EA), eV:	-8.57(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-chloroanilino)diazenyl]-5-methoxy-4-pentoxybenzonitrile

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C(=C1)N=NNC2=CC(=C(C=C2)F)Cl)C#N)OC

DOS

IR

Vibrations